N'-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-(phenylmethyl)ethanediamide

Systemtic Name: N'-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-(phenylmethyl)ethanediamide Openeye Name: N-benzyl-N'-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)oxamide CAS Name: N'-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-(phenylmethyl)oxamide IUPAC Name: N-benzyl-N'-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)oxamide Traditional Name: N-benzyl-N'-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)oxamide Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O2S/c1-12-7-8-14-15(10-20)19(25-16(14)9-12)22-18(24)17(23)21-11-13-5-3-2-4-6-13/h2-6,12H,7-9,11H2,1H3,(H,21,23)(H,22,24)