4-methylsulfanyl-2-(2-phenoxyethanoylamino)-N-(6-piperidin-1-ylpyridin-3-yl)butanamide

Systemtic Name: 4-methylsulfanyl-2-(2-phenoxyethanoylamino)-N-(6-piperidin-1-ylpyridin-3-yl)butanamide Openeye Name: 4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]-N-[6-(1-piperidyl)-3-pyridyl]butanamide CAS Name: 4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]-N-[6-(1-piperidinyl)-3-pyridinyl]butanamide IUPAC Name: 4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]-N-(6-piperidin-1-ylpyridin-3-yl)butanamide Traditional Name: 4-(methylthio)-2-[(2-phenoxyacetyl)amino]-N-(6-piperidino-3-pyridyl)butyramide Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CN=C(C=C1)N2CCCCC2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CSCCC(C(=O)NC1=CN=C(C=C1)N2CCCCC2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C23H30N4O3S/c1-31-15-12-20(26-22(28)17-30-19-8-4-2-5-9-19)23(29)25-18-10-11-21(24-16-18)27-13-6-3-7-14-27/h2,4-5,8-11,16,20H,3,6-7,12-15,17H2,1H3,(H,25,29)(H,26,28)