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

Systemtic Name: N-[3-(cyclohexylmethylsulfanyl)-1-[(4-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]pyridine-4-carboxamide Openeye Name: N-[1-(cyclohexylmethylsulfanylmethyl)-2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl]pyridine-4-carboxamide CAS Name: N-[3-(cyclohexylmethylthio)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl]-4-pyridinecarboxamide IUPAC Name: N-[3-(cyclohexylmethylsulfanyl)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl]pyridine-4-carboxamide Traditional Name: N-[1-[(cyclohexylmethylthio)methyl]-2-keto-2-(p-anisylamino)ethyl]isonicotinamide Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C(CSCC2CCCCC2)NC(=O)C3=CC=NC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C(CSCC2CCCCC2)NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C24H31N3O3S/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/h7-14,19,22H,2-6,15-17H2,1H3,(H,26,29)(H,27,28)