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

Systemtic Name: N-(4-fluoranyl-2-methyl-phenyl)-1-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]piperidine-3-carboxamide Openeye Name: N-(4-fluoro-2-methyl-phenyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(4-fluoro-2-methylphenyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(4-fluoro-2-methylphenyl)-1-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]piperidine-3-carboxamide Traditional Name: N-(4-fluoro-2-methyl-phenyl)-1-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonyl]nipecotamide Formula: C23H26FN3O4S MolecularWeight: 459.533643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

Isomeric SMILES

CC1=C(C=CC(=C1)F)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

InChI

InChI=1S/C23H26FN3O4S/c1-15-12-18(24)7-9-20(15)26-23(29)17-5-3-11-27(14-17)32(30,31)19-8-10-21-16(13-19)4-2-6-22(28)25-21/h7-10,12-13,17H,2-6,11,14H2,1H3,(H,25,28)(H,26,29)