1-(4-bromophenyl)sulfonyl-N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]pyrrolidine-2-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-[2-(2,3-dimethylanilino)-2-oxo-ethyl]pyrrolidine-2-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-[2-(2,3-dimethylanilino)-2-oxoethyl]pyrrolidine-2-carboxamide Traditional Name: 1-brosyl-N-[2-(2,3-dimethylanilino)-2-keto-ethyl]pyrrolidine-2-carboxamide Formula: C21H24BrN3O4S MolecularWeight: 494.40196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CNC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CNC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C21H24BrN3O4S/c1-14-5-3-6-18(15(14)2)24-20(26)13-23-21(27)19-7-4-12-25(19)30(28,29)17-10-8-16(22)9-11-17/h3,5-6,8-11,19H,4,7,12-13H2,1-2H3,(H,23,27)(H,24,26)