4-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]-1H-quinolin-2-one

Systemtic Name: 4-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]-1H-quinolin-2-one Openeye Name: 4-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)-1H-quinolin-2-one CAS Name: 4-[(4-methylsulfonyl-1,4-diazepan-1-yl)-oxomethyl]-1H-quinolin-2-one IUPAC Name: 4-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)-1H-quinolin-2-one Traditional Name: 4-(4-mesyl-1,4-diazepane-1-carbonyl)carbostyril Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C(=O)C2=CC(=O)NC3=CC=CC=C32

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C(=O)C2=CC(=O)NC3=CC=CC=C32

InChI

InChI=1S/C16H19N3O4S/c1-24(22,23)19-8-4-7-18(9-10-19)16(21)13-11-15(20)17-14-6-3-2-5-12(13)14/h2-3,5-6,11H,4,7-10H2,1H3,(H,17,20)