N-(4-methoxy-2-methyl-phenyl)-3-[(3R)-1-(2-phenylsulfanylethanoyl)piperidin-3-yl]propanamide

Systemtic Name: N-(4-methoxy-2-methyl-phenyl)-3-[(3R)-1-(2-phenylsulfanylethanoyl)piperidin-3-yl]propanamide Openeye Name: N-(4-methoxy-2-methyl-phenyl)-3-[(3R)-1-(2-phenylsulfanylacetyl)-3-piperidyl]propanamide CAS Name: N-(4-methoxy-2-methylphenyl)-3-[(3R)-1-[1-oxo-2-(phenylthio)ethyl]-3-piperidinyl]propanamide IUPAC Name: N-(4-methoxy-2-methylphenyl)-3-[(3R)-1-(2-phenylsulfanylacetyl)piperidin-3-yl]propanamide Traditional Name: N-(4-methoxy-2-methyl-phenyl)-3-[(3R)-1-[2-(phenylthio)acetyl]-3-piperidyl]propionamide Formula: C24H30N2O3S MolecularWeight: 426.5716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)NC(=O)CCC2CCCN(C2)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)OC)NC(=O)CC[C@H]2CCCN(C2)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C24H30N2O3S/c1-18-15-20(29-2)11-12-22(18)25-23(27)13-10-19-7-6-14-26(16-19)24(28)17-30-21-8-4-3-5-9-21/h3-5,8-9,11-12,15,19H,6-7,10,13-14,16-17H2,1-2H3,(H,25,27)/t19-/m1/s1