2-[bis(phenylmethyl)amino]-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanamide

Systemtic Name: 2-[bis(phenylmethyl)amino]-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanamide Openeye Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(dibenzylamino)acetamide CAS Name: 2-[bis(phenylmethyl)amino]-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide IUPAC Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(dibenzylamino)acetamide Traditional Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(dibenzylamino)acetamide Formula: C27H29N3OS MolecularWeight: 443.60366

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)CN(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)CN(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H29N3OS/c1-2-20-13-14-23-24(16-28)27(32-25(23)15-20)29-26(31)19-30(17-21-9-5-3-6-10-21)18-22-11-7-4-8-12-22/h3-12,20H,2,13-15,17-19H2,1H3,(H,29,31)