Chemical ID: 7680570

CC(C)(C)C(=O)N1CCN(CC1)c2ccc(cc2)NC(=O)c3cccs3
Chemical ID:
7680570
Name [?]:
None
SMILES [?]:
CC(C)(C)C(=O)N1CCN(CC1)c2ccc(cc2)NC(=O)c3cccs3
InChi [?]:
InChI=1/C20H25N3O2S/c1-20(2,3)19(25)23-12-10-22(11-13-23)16-8-6-15(7-9-16)21-18(24)17-5-4-14-26-17/h4-9,14H,10-13H2,1-3H3,(H,21,24)
InChi Info:
AuxInfo=1/1/N:1,3,4,24,23,15,17,14,18,9,11,8,12,25,16,13,22,20,5,2,19,10,7,21,6,26/E:(1,2,3)(6,7)(8,9)(10,11)(12,13)/rA:26nCCCCCONCCNCCCCCCCCNCOCCCCS/rB:s1;s2;s2;s2;d5;s5;s7;s8;s9;s10;s7s11;s10;s13;d14;s15;d16;d13s17;s16;s19;d20;s20;d22;s23;d24;s22s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H25N3O2S
All Atoms:51
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:11.1453
Area:584.048
Solvation:-3.45593
Coulombic:-45.0648
Bond Count [?]
All:28
Single:21
Double:7
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.41
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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