N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-3-phenylsulfanyl-propanamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-3-phenylsulfanyl-propanamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]-3-phenylsulfanyl-propanamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(1-pyrrolidinyl)ethyl]-3-(phenylthio)propanamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ylethyl]-3-phenylsulfanylpropanamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-pyrrolidino-ethyl]-3-(phenylthio)propionamide Formula: C23H31N3OS MolecularWeight: 397.57674

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)CCSC2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)CCSC2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C23H31N3OS/c1-25(2)20-12-10-19(11-13-20)22(26-15-6-7-16-26)18-24-23(27)14-17-28-21-8-4-3-5-9-21/h3-5,8-13,22H,6-7,14-18H2,1-2H3,(H,24,27)