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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H22N2O3S/c32-27(31(21-11-3-1-4-12-21)22-13-5-2-6-14-22)19-20-34-29(33)24-16-8-7-15-23(24)28-30-25-17-9-10-18-26(25)35-28/h1-18H,19-20H2