N'-(4-bromophenyl)sulfonyl-N-(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)benzenecarboximidamide

Systemtic Name: N'-(4-bromophenyl)sulfonyl-N-(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)benzenecarboximidamide Openeye Name: N'-(4-bromophenyl)sulfonyl-N-(3,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)benzamidine CAS Name: N'-(4-bromophenyl)sulfonyl-N-(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)benzenecarboximidamide IUPAC Name: N'-(4-bromophenyl)sulfonyl-N-(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)benzenecarboximidamide Traditional Name: N'-brosyl-N-(4-keto-3,5-dimethyl-cyclohexa-2,5-dien-1-ylidene)benzamidine Formula: C21H17BrN2O3S MolecularWeight: 457.34028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=NS(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3)C=C(C1=O)C

Isomeric SMILES

CC1=CC(=N/C(=N/S(=O)(=O)C2=CC=C(C=C2)Br)/C3=CC=CC=C3)C=C(C1=O)C

InChI

InChI=1S/C21H17BrN2O3S/c1-14-12-18(13-15(2)20(14)25)23-21(16-6-4-3-5-7-16)24-28(26,27)19-10-8-17(22)9-11-19/h3-13H,1-2H3/b24-21+