[1-(diphenylamino)-1-oxidanylidene-propan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate

Systemtic Name: [1-(diphenylamino)-1-oxidanylidene-propan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate Openeye Name: [1-methyl-2-oxo-2-(N-phenylanilino)ethyl] 2-(1,3-benzothiazol-2-yl)benzoate CAS Name: 2-(1,3-benzothiazol-2-yl)benzoic acid [1-oxo-1-(N-phenylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(N-phenylanilino)propan-2-yl] 2-(1,3-benzothiazol-2-yl)benzoate Traditional Name: 2-(1,3-benzothiazol-2-yl)benzoic acid [2-keto-1-methyl-2-(N-phenylanilino)ethyl] ester Formula: C29H22N2O3S MolecularWeight: 478.56158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C29H22N2O3S/c1-20(28(32)31(21-12-4-2-5-13-21)22-14-6-3-7-15-22)34-29(33)24-17-9-8-16-23(24)27-30-25-18-10-11-19-26(25)35-27/h2-20H,1H3