4-[[N-(4-bromophenyl)sulfonyl-C-phenyl-carbonimidoyl]amino]-3-methyl-phenolate

Systemtic Name: 4-[[N-(4-bromophenyl)sulfonyl-C-phenyl-carbonimidoyl]amino]-3-methyl-phenolate Openeye Name: 4-[[N-(4-bromophenyl)sulfonyl-C-phenyl-carbonimidoyl]amino]-3-methyl-phenolate CAS Name: 4-[[(4-bromophenyl)sulfonylimino-phenylmethyl]amino]-3-methylphenolate IUPAC Name: 4-[[N-(4-bromophenyl)sulfonyl-C-phenylcarbonimidoyl]amino]-3-methylphenolate Traditional Name: 4-[(N-brosyl-C-phenyl-carbonimidoyl)amino]-3-methyl-phenolate Formula: C20H16BrN2O3S- MolecularWeight: 444.32164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17BrN2O3S/c1-14-13-17(24)9-12-19(14)22-20(15-5-3-2-4-6-15)23-27(25,26)18-10-7-16(21)8-11-18/h2-13,24H,1H3,(H,22,23)/p-1