N-(3-chloranyl-4-methyl-phenyl)-1-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-1-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-1-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide Formula: C22H24ClN3O4S MolecularWeight: 461.96166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4)Cl

InChI

InChI=1S/C22H24ClN3O4S/c1-14-7-8-16(13-18(14)23)24-22(28)20-5-3-11-26(20)31(29,30)17-9-10-19-15(12-17)4-2-6-21(27)25-19/h7-10,12-13,20H,2-6,11H2,1H3,(H,24,28)(H,25,27)