(2S)-N-[(4-aminocarbonylphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(4-aminocarbonylphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(4-carbamoylphenyl)methyl]-N-methyl-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(4-carbamoylphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(4-carbamoylphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-(4-carbamoylbenzyl)-N-methyl-1-tosyl-pyrrolidine-2-carboxamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N(C)CC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N(C)CC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H25N3O4S/c1-15-5-11-18(12-6-15)29(27,28)24-13-3-4-19(24)21(26)23(2)14-16-7-9-17(10-8-16)20(22)25/h5-12,19H,3-4,13-14H2,1-2H3,(H2,22,25)/t19-/m0/s1