Chemical ID: 7432406

C(#N)c1c2c(nc3c1sc(=O)s3)sc(=O)s2
Chemical ID:
7432406
Name [?]:
None
SMILES [?]:
C(#N)c1c2c(nc3c1sc(=O)s3)sc(=O)s2
InChi [?]:
InChI=1/C8N2O2S4/c9-1-2-3-5(15-7(11)13-3)10-6-4(2)14-8(12)16-6
InChi Info:
AuxInfo=1/0/N:1,3,4,8,5,7,14,10,2,6,15,11,16,9,13,12/E:(3,4)(5,6)(7,8)(11,12)(13,14)(15,16)/rA:16nCNCCCNCCSCOSSCOS/rB:t1;s1;s3;d4;s5;d6;d3s7;s8;s9;d10;s7s10;s5;s13;d14;s4s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8N2O2S4
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.35422
Area:419.422
Solvation:-3.13132
Coulombic:-26.3245
Bond Count [?]
All:18
Single:12
Double:5
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:284.362
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.83
LogP (Chemaxon):3.92

Name Annotations

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

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

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

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

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

Chemical MixSourceExternal IDDescriptorValue