N-(4-bromanyl-3-methyl-phenyl)-1-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)sulfonyl]pyrrolidine-2-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-1-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)sulfonyl]pyrrolidine-2-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-1-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)sulfonyl]pyrrolidine-2-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-1-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)sulfonyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-1-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)sulfonyl]pyrrolidine-2-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-1-[(2-keto-3,4-dihydro-1H-quinolin-6-yl)sulfonyl]pyrrolidine-2-carboxamide Formula: C21H22BrN3O4S MolecularWeight: 492.38608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC4)Br

InChI

InChI=1S/C21H22BrN3O4S/c1-13-11-15(5-7-17(13)22)23-21(27)19-3-2-10-25(19)30(28,29)16-6-8-18-14(12-16)4-9-20(26)24-18/h5-8,11-12,19H,2-4,9-10H2,1H3,(H,23,27)(H,24,26)