[4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-5-methyl-2-propan-2-yl-phenyl] benzoate

Systemtic Name: [4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-5-methyl-2-propan-2-yl-phenyl] benzoate Openeye Name: [4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-2-isopropyl-5-methyl-phenyl] benzoate CAS Name: benzoic acid [4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-5-methyl-2-propan-2-ylphenyl] ester IUPAC Name: [4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-5-methyl-2-propan-2-ylphenyl] benzoate Traditional Name: benzoic acid [4-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-2-isopropyl-5-methyl-phenyl] ester Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)OC(=O)C2=CC=CC=C2)C(C)C)NC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=C(C=C(C(=C1)OC(=O)C2=CC=CC=C2)C(C)C)NC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C24H22N2O4S/c1-15(2)19-14-20(25-23-18-11-7-8-12-22(18)31(28,29)26-23)16(3)13-21(19)30-24(27)17-9-5-4-6-10-17/h4-15H,1-3H3,(H,25,26)