(2S)-1-(4-methylphenyl)sulfonyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(4-methylphenyl)sulfonyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(2-phenylpropyl)-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-(4-methylphenyl)sulfonyl-N-(2-phenylpropyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(4-methylphenyl)sulfonyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(2-phenylpropyl)-1-tosyl-pyrrolidine-2-carboxamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NCC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NCC(C)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3S/c1-16-10-12-19(13-11-16)27(25,26)23-14-6-9-20(23)21(24)22-15-17(2)18-7-4-3-5-8-18/h3-5,7-8,10-13,17,20H,6,9,14-15H2,1-2H3,(H,22,24)/t17?,20-/m0/s1