N-(3-chloranyl-4-fluoranyl-phenyl)-3-methyl-2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3-methyl-2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3-methyl-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide CAS Name: N-(3-chloro-4-fluorophenyl)-3-methyl-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3-methyl-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2,4-diketo-3-methyl-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Formula: C16H13ClFN3O4S MolecularWeight: 397.808523

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(C=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)F)Cl)NC1=O

Isomeric SMILES

CC1C(=O)NC2=C(C=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)F)Cl)NC1=O

InChI

InChI=1S/C16H13ClFN3O4S/c1-8-15(22)19-13-5-3-10(7-14(13)20-16(8)23)26(24,25)21-9-2-4-12(18)11(17)6-9/h2-8,21H,1H3,(H,19,22)(H,20,23)