7-chloranyl-N-(2-cyanoethyl)-5,5-bis(oxidanylidene)-N-phenyl-4H-thieno[3,2-c]thiochromene-2-carboxamide

Systemtic Name: 7-chloranyl-N-(2-cyanoethyl)-5,5-bis(oxidanylidene)-N-phenyl-4H-thieno[3,2-c]thiochromene-2-carboxamide Openeye Name: 7-chloro-N-(2-cyanoethyl)-5,5-dioxo-N-phenyl-4H-thieno[3,2-c]thiochromene-2-carboxamide CAS Name: 7-chloro-N-(2-cyanoethyl)-5,5-dioxo-N-phenyl-4H-thieno[3,2-c]thiochromene-2-carboxamide IUPAC Name: 7-chloro-N-(2-cyanoethyl)-5,5-dioxo-N-phenyl-4H-thieno[3,2-c]thiochromene-2-carboxamide Traditional Name: 7-chloro-N-(2-cyanoethyl)-5,5-diketo-N-phenyl-4H-thieno[3,2-c]thiochromene-2-carboxamide Formula: C21H15ClN2O3S2 MolecularWeight: 442.9384

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C3=C(S1(=O)=O)C=C(C=C3)Cl)SC(=C2)C(=O)N(CCC#N)C4=CC=CC=C4

Isomeric SMILES

C1C2=C(C3=C(S1(=O)=O)C=C(C=C3)Cl)SC(=C2)C(=O)N(CCC#N)C4=CC=CC=C4

InChI

InChI=1S/C21H15ClN2O3S2/c22-15-7-8-17-19(12-15)29(26,27)13-14-11-18(28-20(14)17)21(25)24(10-4-9-23)16-5-2-1-3-6-16/h1-3,5-8,11-12H,4,10,13H2