[2-[(4-hydroxyphenyl)amino]-2-oxidanylidene-ethyl] 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: [2-[(4-hydroxyphenyl)amino]-2-oxidanylidene-ethyl] 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate Openeye Name: [2-(4-hydroxyanilino)-2-oxo-ethyl] 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]benzoic acid [2-(4-hydroxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-hydroxyanilino)-2-oxoethyl] 4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoate Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]benzoic acid [2-(4-hydroxyanilino)-2-keto-ethyl] ester Formula: C23H18N2O4S2 MolecularWeight: 450.53002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)OCC(=O)NC4=CC=C(C=C4)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC3=CC=C(C=C3)C(=O)OCC(=O)NC4=CC=C(C=C4)O

InChI

InChI=1S/C23H18N2O4S2/c26-18-11-9-17(10-12-18)24-21(27)13-29-22(28)16-7-5-15(6-8-16)14-30-23-25-19-3-1-2-4-20(19)31-23/h1-12,26H,13-14H2,(H,24,27)