Chemical ID: 7706170

Cc1ccccc1c2nc(sn2)SCC(=O)Nc3nc(cs3)C
Chemical ID:
7706170
Name [?]:
None
SMILES [?]:
Cc1ccccc1c2nc(sn2)SCC(=O)Nc3nc(cs3)C
InChi [?]:
InChI=1/C15H14N4OS3/c1-9-5-3-4-6-11(9)13-18-15(23-19-13)22-8-12(20)17-14-16-10(2)7-21-14/h3-7H,8H2,1-2H3,(H,16,17,20)
InChi Info:
AuxInfo=1/1/N:1,23,4,5,3,6,21,14,2,20,7,15,8,18,10,19,17,9,12,16,22,13,11/rA:23nCCCCCCCCNCSNSCCONCNCCSC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s10;d8s11;s10;s13;s14;d15;s15;s17;d18;s19;d20;s18s21;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14N4OS3
All Atoms:37
Heavy Atoms:23
Chiral Atoms:None
ZAP Information [?]
Total:10.8071
Area:564.232
Solvation:-3.29868
Coulombic:-36.2848
Bond Count [?]
All:25
Single:17
Double:8
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.81
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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