N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[4-(1-naphthylmethyl)piperazin-1-yl]acetamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(1-naphthalenylmethyl)-1-piperazinyl]acetamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-[4-(1-naphthylmethyl)piperazino]acetamide Formula: C26H28N4OS MolecularWeight: 444.59172

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CN3CCN(CC3)CC4=CC=CC5=CC=CC=C54)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CN3CCN(CC3)CC4=CC=CC5=CC=CC=C54)C#N

InChI

InChI=1S/C26H28N4OS/c27-16-23-22-10-3-4-11-24(22)32-26(23)28-25(31)18-30-14-12-29(13-15-30)17-20-8-5-7-19-6-1-2-9-21(19)20/h1-2,5-9H,3-4,10-15,17-18H2,(H,28,31)