(2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-1-tosyl-pyrrolidine-2-carboxamide Formula: C24H32N2O5S MolecularWeight: 460.58628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=C(C=C3)C)OCC

InChI

InChI=1S/C24H32N2O5S/c1-4-30-22-13-10-19(17-23(22)31-5-2)14-15-25-24(27)21-7-6-16-26(21)32(28,29)20-11-8-18(3)9-12-20/h8-13,17,21H,4-7,14-16H2,1-3H3,(H,25,27)/t21-/m0/s1