N-[(2,4-dimethoxyphenyl)methyl]-3-[(3R)-1-(3-methylsulfanylpropanoyl)piperidin-3-yl]propanamide

Systemtic Name: N-[(2,4-dimethoxyphenyl)methyl]-3-[(3R)-1-(3-methylsulfanylpropanoyl)piperidin-3-yl]propanamide Openeye Name: N-[(2,4-dimethoxyphenyl)methyl]-3-[(3R)-1-(3-methylsulfanylpropanoyl)-3-piperidyl]propanamide CAS Name: N-[(2,4-dimethoxyphenyl)methyl]-3-[(3R)-1-[3-(methylthio)-1-oxopropyl]-3-piperidinyl]propanamide IUPAC Name: N-[(2,4-dimethoxyphenyl)methyl]-3-[(3R)-1-(3-methylsulfanylpropanoyl)piperidin-3-yl]propanamide Traditional Name: N-(2,4-dimethoxybenzyl)-3-[(3R)-1-[3-(methylthio)propanoyl]-3-piperidyl]propionamide Formula: C21H32N2O4S MolecularWeight: 408.55478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC(=O)CCC2CCCN(C2)C(=O)CCSC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC(=O)CC[C@H]2CCCN(C2)C(=O)CCSC)OC

InChI

InChI=1S/C21H32N2O4S/c1-26-18-8-7-17(19(13-18)27-2)14-22-20(24)9-6-16-5-4-11-23(15-16)21(25)10-12-28-3/h7-8,13,16H,4-6,9-12,14-15H2,1-3H3,(H,22,24)/t16-/m1/s1