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

Systemtic Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(phenylmethyl)piperidin-1-yl]ethanamide Openeye Name: 2-(4-benzyl-1-piperidyl)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide CAS Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(phenylmethyl)-1-piperidinyl]acetamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide Traditional Name: 2-(4-benzylpiperidino)-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C25H31N3OS MolecularWeight: 421.59814

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)CN3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)CN3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H31N3OS/c1-2-18-8-9-21-22(16-26)25(30-23(21)15-18)27-24(29)17-28-12-10-20(11-13-28)14-19-6-4-3-5-7-19/h3-7,18,20H,2,8-15,17H2,1H3,(H,27,29)