N-(phenylmethyl)-1-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)piperidine-4-carboxamide

Systemtic Name: N-(phenylmethyl)-1-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-(4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)piperidine-4-carboxamide Traditional Name: N-benzyl-1-(4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)isonipecotamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H26N2O2S/c25-21(23-14-16-6-2-1-3-7-16)17-10-12-24(13-11-17)22(26)19-15-27-20-9-5-4-8-18(19)20/h1-3,6-7,15,17H,4-5,8-14H2,(H,23,25)