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Chemical ID: 7743635

CN(C)CCCNC(=O)C(=O)NCC(c1cccs1)S(=O)(=O)c2ccc(cc2)Cl

Chemical ID:

7743635

Name [?]:

None

SMILES [?]:

CN(C)CCCNC(=O)C(=O)NCC(c1cccs1)S(=O)(=O)c2ccc(cc2)Cl

InChi [?]:

InChI=1/C19H24ClN3O4S2/c1-23(2)11-4-10-21-18(24)19(25)22-13-17(16-5-3-12-28-16)29(26,27)15-8-6-14(20)7-9-15/h3,5-9,12,17H,4,10-11,13H2,1-2H3,(H,21,24)(H,22,25)

InChi Info:

AuxInfo=1/1/N:1,3,17,5,16,25,27,24,28,6,4,18,13,26,23,15,14,8,10,29,7,12,2,9,11,21,22,19,20/E:(1,2)(6,7)(8,9)(26,27)/CRV:29.6/rA:29cCNCCCCNCOCONCCCCCCSSOOCCCCCCCl/rB:s1;s2;s2;s4;s5;s6;s7;d8;s8;d10;s10;s12;s13;s14;d15;s16;d17;s15s18;s14;d20;d20;s20;s23;d24;s25;d26;d23s27;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₉H₂₄ClN₃O₄S₂
All Atoms:	53
Heavy Atoms:	29
Chiral Atoms:	None

ZAP Information [?]

Total:	12.7728
Area:	687.655
Solvation:	-4.41858
Coulombic:	-56.4406

Bond Count [?]

All:	30
Single:	21
Double:	9
Rotors:	12
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	1.44
LogP (Chemaxon):	None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value