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Chemical ID: 7707837
Chemical ID:
7707837
Name [?]:
None
SMILES [?]:
Cc1ccccc1S(=O)(=O)Nc2ccc(c(c2)Cl)NS(=O)(=O)c3ccccc3C
InChi [?]:
InChI=1/C20H19ClN2O4S2/c1-14-7-3-5-9-19(14)28(24,25)22-16-11-12-18(17(21)13-16)23-29(26,27)20-10-6-4-8-15(20)2/h3-13,22-23H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,29,4,26,5,25,3,27,6,24,13,14,17,2,28,12,16,15,7,23,18,11,19,9,10,21,22,8,20/E:(24,25)(26,27)/CRV:28.6,29.6/rA:29nCCCCCCCSOONCCCCCCClNSOOCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;d8;s8;s11;s12;d13;s14;d15;d12s16;s16;s15;s19;d20;d20;s20;s23;d24;s25;d26;d23s27;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C20H19ClN2O4S2 |
All Atoms: | 48 |
Heavy Atoms: | 29 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 12.2609 |
Area: | 607.989 |
Solvation: | -2.93882 |
Coulombic: | -26.5075 |
Bond Count [?]
All: | 31 |
Single: | 18 |
Double: | 13 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.06 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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