6-(2-chlorophenyl)-8-methylsulfanyl-5-oxidanidyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium

Systemtic Name: 6-(2-chlorophenyl)-8-methylsulfanyl-5-oxidanidyl-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Openeye Name: 6-(2-chlorophenyl)-8-methylsulfanyl-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium CAS Name: 6-(2-chlorophenyl)-8-(methylthio)-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium IUPAC Name: 6-(2-chlorophenyl)-8-methylsulfanyl-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Traditional Name: 6-(2-chlorophenyl)-8-(methylthio)-5-oxido-4H-imidazo[1,2-a][1,4]benzodiazepin-5-ium Formula: C18H14ClN3OS MolecularWeight: 355.84126

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N3C=CN=C3C[N+](=C2C4=CC=CC=C4Cl)[O-]

Isomeric SMILES

CSC1=CC2=C(C=C1)N3C=CN=C3C[N+](=C2C4=CC=CC=C4Cl)[O-]

InChI

InChI=1S/C18H14ClN3OS/c1-24-12-6-7-16-14(10-12)18(13-4-2-3-5-15(13)19)22(23)11-17-20-8-9-21(16)17/h2-10H,11H2,1H3