2-(benzotriazol-1-yl)-N-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]ethanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-[2-(2,4-dimethoxyanilino)-2-oxo-ethyl]-N-[(4-phenylthiazol-2-yl)methyl]acetamide CAS Name: 2-(1-benzotriazolyl)-N-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-N-[(4-phenyl-2-thiazolyl)methyl]acetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]acetamide Traditional Name: 2-(benzotriazol-1-yl)-N-[2-(2,4-dimethoxyanilino)-2-keto-ethyl]-N-[(4-phenylthiazol-2-yl)methyl]acetamide Formula: C28H26N6O4S MolecularWeight: 542.60884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CN(CC2=NC(=CS2)C3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CN(CC2=NC(=CS2)C3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4)OC

InChI

InChI=1S/C28H26N6O4S/c1-37-20-12-13-22(25(14-20)38-2)29-26(35)15-33(16-27-30-23(18-39-27)19-8-4-3-5-9-19)28(36)17-34-24-11-7-6-10-21(24)31-32-34/h3-14,18H,15-17H2,1-2H3,(H,29,35)