2-methyl-4-[[C-phenyl-N-(phenylsulfonyl)carbonimidoyl]amino]-5-propan-2-yl-phenolate

Systemtic Name: 2-methyl-4-[[C-phenyl-N-(phenylsulfonyl)carbonimidoyl]amino]-5-propan-2-yl-phenolate Openeye Name: 4-[[N-(benzenesulfonyl)-C-phenyl-carbonimidoyl]amino]-5-isopropyl-2-methyl-phenolate CAS Name: 4-[[benzenesulfonylimino(phenyl)methyl]amino]-2-methyl-5-propan-2-ylphenolate IUPAC Name: 4-[[N-(benzenesulfonyl)-C-phenylcarbonimidoyl]amino]-2-methyl-5-propan-2-ylphenolate Traditional Name: 4-[(N-besyl-C-phenyl-carbonimidoyl)amino]-5-isopropyl-2-methyl-phenolate Formula: C23H23N2O3S- MolecularWeight: 407.50532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24N2O3S/c1-16(2)20-15-22(26)17(3)14-21(20)24-23(18-10-6-4-7-11-18)25-29(27,28)19-12-8-5-9-13-19/h4-16,26H,1-3H3,(H,24,25)/p-1