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

Systemtic Name: N-(3-methylphenyl)-1-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide Openeye Name: N-(m-tolyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide CAS Name: N-(3-methylphenyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(3-methylphenyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]pyrrolidine-2-carboxamide Traditional Name: 1-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]-N-(m-tolyl)pyrrolidine-2-carboxamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O4S/c1-15-5-2-7-17(13-15)23-22(27)20-8-4-12-25(20)30(28,29)18-10-11-19-16(14-18)6-3-9-21(26)24-19/h2,5,7,10-11,13-14,20H,3-4,6,8-9,12H2,1H3,(H,23,27)(H,24,26)