2-chloranyl-N-(4-fluorophenyl)-5,5-bis(oxidanylidene)-8,9,10,11-tetrahydro-7H-azepino[2,1-c][1,2,4]benzothiadiazine-3-carboxamide

Systemtic Name: 2-chloranyl-N-(4-fluorophenyl)-5,5-bis(oxidanylidene)-8,9,10,11-tetrahydro-7H-azepino[2,1-c][1,2,4]benzothiadiazine-3-carboxamide Openeye Name: 2-chloro-N-(4-fluorophenyl)-5,5-dioxo-8,9,10,11-tetrahydro-7H-azepino[2,1-c][1,2,4]benzothiadiazine-3-carboxamide CAS Name: 2-chloro-N-(4-fluorophenyl)-5,5-dioxo-8,9,10,11-tetrahydro-7H-azepino[2,1-c][1,2,4]benzothiadiazine-3-carboxamide IUPAC Name: 2-chloro-N-(4-fluorophenyl)-5,5-dioxo-8,9,10,11-tetrahydro-7H-azepino[2,1-c][1,2,4]benzothiadiazine-3-carboxamide Traditional Name: 2-chloro-N-(4-fluorophenyl)-5,5-diketo-8,9,10,11-tetrahydro-7H-azepino[2,1-c][1,2,4]benzothiadiazine-3-carboxamide Formula: C19H17ClFN3O3S MolecularWeight: 421.872983

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NS(=O)(=O)C3=C(N2CC1)C=C(C(=C3)C(=O)NC4=CC=C(C=C4)F)Cl

Isomeric SMILES

C1CCC2=NS(=O)(=O)C3=C(N2CC1)C=C(C(=C3)C(=O)NC4=CC=C(C=C4)F)Cl

InChI

InChI=1S/C19H17ClFN3O3S/c20-15-11-16-17(28(26,27)23-18-4-2-1-3-9-24(16)18)10-14(15)19(25)22-13-7-5-12(21)6-8-13/h5-8,10-11H,1-4,9H2,(H,22,25)