2-[(3-cyano-5-oxidanylidene-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanamide

Systemtic Name: 2-[(3-cyano-5-oxidanylidene-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanamide Openeye Name: 2-[(3-cyano-5-oxo-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide CAS Name: 2-[(3-cyano-5-oxo-7,8-dihydro-6H-quinolin-2-yl)thio]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide IUPAC Name: 2-[(3-cyano-5-oxo-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide Traditional Name: 2-[(3-cyano-5-keto-7,8-dihydro-6H-quinolin-2-yl)thio]-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CSC3=NC4=C(C=C3C#N)C(=O)CCC4)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CSC3=NC4=C(C=C3C#N)C(=O)CCC4)C#N

InChI

InChI=1S/C21H18N4O2S2/c22-9-12-8-14-16(5-3-6-17(14)26)24-20(12)28-11-19(27)25-21-15(10-23)13-4-1-2-7-18(13)29-21/h8H,1-7,11H2,(H,25,27)