[2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 1,3-benzothiazole-6-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2-(phenylmethyl)phenyl]amino]ethyl] 1,3-benzothiazole-6-carboxylate Openeye Name: [2-(2-benzylanilino)-2-oxo-ethyl] 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [2-oxo-2-[2-(phenylmethyl)anilino]ethyl] ester IUPAC Name: [2-(2-benzylanilino)-2-oxoethyl] 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [2-(2-benzylanilino)-2-keto-ethyl] ester Formula: C23H18N2O3S MolecularWeight: 402.46562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)COC(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C23H18N2O3S/c26-22(14-28-23(27)18-10-11-20-21(13-18)29-15-24-20)25-19-9-5-4-8-17(19)12-16-6-2-1-3-7-16/h1-11,13,15H,12,14H2,(H,25,26)