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

Systemtic Name: N'-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-(phenylmethyl)ethanediamide Openeye Name: N-benzyl-N'-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)oxamide CAS Name: N'-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-(phenylmethyl)oxamide IUPAC Name: N-benzyl-N'-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)oxamide Traditional Name: N-benzyl-N'-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)oxamide Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C(=O)NCC3=CC=CC=C3)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C(=O)NCC3=CC=CC=C3)C#N

InChI

InChI=1S/C18H17N3O2S/c19-10-14-13-8-4-5-9-15(13)24-18(14)21-17(23)16(22)20-11-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-9,11H2,(H,20,22)(H,21,23)