N-cyclopropyl-1-[1-(2-phenylsulfanylethanoyl)piperidin-4-yl]piperidine-4-carboxamide

Systemtic Name: N-cyclopropyl-1-[1-(2-phenylsulfanylethanoyl)piperidin-4-yl]piperidine-4-carboxamide Openeye Name: N-cyclopropyl-1-[1-(2-phenylsulfanylacetyl)-4-piperidyl]piperidine-4-carboxamide CAS Name: N-cyclopropyl-1-[1-[1-oxo-2-(phenylthio)ethyl]-4-piperidinyl]-4-piperidinecarboxamide IUPAC Name: N-cyclopropyl-1-[1-(2-phenylsulfanylacetyl)piperidin-4-yl]piperidine-4-carboxamide Traditional Name: N-cyclopropyl-1-[1-[2-(phenylthio)acetyl]-4-piperidyl]isonipecotamide Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2CCN(CC2)C3CCN(CC3)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

C1CC1NC(=O)C2CCN(CC2)C3CCN(CC3)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C22H31N3O2S/c26-21(16-28-20-4-2-1-3-5-20)25-14-10-19(11-15-25)24-12-8-17(9-13-24)22(27)23-18-6-7-18/h1-5,17-19H,6-16H2,(H,23,27)