2-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 2-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 2-[2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]sulfanyl-4,6-dimethyl-N-phenyl-pyridine-3-carboxamide CAS Name: 2-[[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]thio]-4,6-dimethyl-N-phenyl-3-pyridinecarboxamide IUPAC Name: 2-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]sulfanyl-4,6-dimethyl-N-phenylpyridine-3-carboxamide Traditional Name: 2-[[2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-keto-ethyl]thio]-4,6-dimethyl-N-phenyl-nicotinamide Formula: C25H24N4O2S2 MolecularWeight: 476.61366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)NC2=CC=CC=C2)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)NC2=CC=CC=C2)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N)C

InChI

InChI=1S/C25H24N4O2S2/c1-15-12-16(2)27-25(22(15)23(31)28-17-8-4-3-5-9-17)32-14-21(30)29-24-19(13-26)18-10-6-7-11-20(18)33-24/h3-5,8-9,12H,6-7,10-11,14H2,1-2H3,(H,28,31)(H,29,30)