8-chloranyl-6-(2-fluorophenyl)-1-methyl-3-methylsulfonyl-5-oxidanidyl-4H-imidazo[1,5-a][1,4]benzodiazepin-5-ium

Systemtic Name: 8-chloranyl-6-(2-fluorophenyl)-1-methyl-3-methylsulfonyl-5-oxidanidyl-4H-imidazo[1,5-a][1,4]benzodiazepin-5-ium Openeye Name: 8-chloro-6-(2-fluorophenyl)-1-methyl-3-methylsulfonyl-5-oxido-4H-imidazo[1,5-a][1,4]benzodiazepin-5-ium CAS Name: 8-chloro-6-(2-fluorophenyl)-1-methyl-3-methylsulfonyl-5-oxido-4H-imidazo[1,5-a][1,4]benzodiazepin-5-ium IUPAC Name: 8-chloro-6-(2-fluorophenyl)-1-methyl-3-methylsulfonyl-5-oxido-4H-imidazo[1,5-a][1,4]benzodiazepin-5-ium Traditional Name: 8-chloro-6-(2-fluorophenyl)-3-mesyl-1-methyl-5-oxido-4H-imidazo[1,5-a][1,4]benzodiazepin-5-ium Formula: C19H15ClFN3O3S MolecularWeight: 419.857103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2N1C3=C(C=C(C=C3)Cl)C(=[N+](C2)[O-])C4=CC=CC=C4F)S(=O)(=O)C

Isomeric SMILES

CC1=NC(=C2N1C3=C(C=C(C=C3)Cl)C(=[N+](C2)[O-])C4=CC=CC=C4F)S(=O)(=O)C

InChI

InChI=1S/C19H15ClFN3O3S/c1-11-22-19(28(2,26)27)17-10-23(25)18(13-5-3-4-6-15(13)21)14-9-12(20)7-8-16(14)24(11)17/h3-9H,10H2,1-2H3