3-methylsulfanyl-N-[1-(phenylmethyl)piperidin-4-yl]-3-pyrrolidin-2-yl-propanamide

Systemtic Name: 3-methylsulfanyl-N-[1-(phenylmethyl)piperidin-4-yl]-3-pyrrolidin-2-yl-propanamide Openeye Name: N-(1-benzyl-4-piperidyl)-3-methylsulfanyl-3-pyrrolidin-2-yl-propanamide CAS Name: 3-(methylthio)-N-[1-(phenylmethyl)-4-piperidinyl]-3-(2-pyrrolidinyl)propanamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-3-methylsulfanyl-3-pyrrolidin-2-ylpropanamide Traditional Name: N-(1-benzyl-4-piperidyl)-3-(methylthio)-3-pyrrolidin-2-yl-propionamide Formula: C20H31N3OS MolecularWeight: 361.54464

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC(=O)NC1CCN(CC1)CC2=CC=CC=C2)C3CCCN3

Isomeric SMILES

CSC(CC(=O)NC1CCN(CC1)CC2=CC=CC=C2)C3CCCN3

InChI

InChI=1S/C20H31N3OS/c1-25-19(18-8-5-11-21-18)14-20(24)22-17-9-12-23(13-10-17)15-16-6-3-2-4-7-16/h2-4,6-7,17-19,21H,5,8-15H2,1H3,(H,22,24)