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

Systemtic Name: N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-phenyl-2-(phenylmethyl)propanamide Openeye Name: 2-benzyl-N-(3-cyano-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-phenyl-propanamide CAS Name: N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-phenyl-2-(phenylmethyl)propanamide IUPAC Name: 2-benzyl-N-(3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-phenylpropanamide Traditional Name: 2-benzyl-N-(3-cyano-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-phenyl-propionamide Formula: C26H26N2OS MolecularWeight: 414.56244

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C(S2)NC(=O)C(CC3=CC=CC=C3)CC4=CC=CC=C4)C#N

Isomeric SMILES

CC1CCC2=C(C1)C(=C(S2)NC(=O)C(CC3=CC=CC=C3)CC4=CC=CC=C4)C#N

InChI

InChI=1S/C26H26N2OS/c1-18-12-13-24-22(14-18)23(17-27)26(30-24)28-25(29)21(15-19-8-4-2-5-9-19)16-20-10-6-3-7-11-20/h2-11,18,21H,12-16H2,1H3,(H,28,29)