N-[(2R)-3-(cyclohexylmethylsulfanyl)-1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]piperidine-4-carboxamide

Systemtic Name: N-[(2R)-3-(cyclohexylmethylsulfanyl)-1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]piperidine-4-carboxamide Openeye Name: N-[(1R)-1-(cyclohexylmethylsulfanylmethyl)-2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: N-[(2R)-3-(cyclohexylmethylthio)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl]-4-piperidinecarboxamide IUPAC Name: N-[(2R)-3-(cyclohexylmethylsulfanyl)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl]piperidine-4-carboxamide Traditional Name: N-[(1R)-1-[(cyclohexylmethylthio)methyl]-2-keto-2-(p-anisylamino)ethyl]isonipecotamide Formula: C24H37N3O3S MolecularWeight: 447.63388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C(CSCC2CCCCC2)NC(=O)C3CCNCC3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)[C@H](CSCC2CCCCC2)NC(=O)C3CCNCC3

InChI

InChI=1S/C24H37N3O3S/c1-30-21-9-7-18(8-10-21)15-26-24(29)22(17-31-16-19-5-3-2-4-6-19)27-23(28)20-11-13-25-14-12-20/h7-10,19-20,22,25H,2-6,11-17H2,1H3,(H,26,29)(H,27,28)/t22-/m0/s1