[2-[2-(diphenylmethylidene)hydrazinyl]-2-oxidanylidene-ethyl] 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoate

Systemtic Name: [2-[2-(diphenylmethylidene)hydrazinyl]-2-oxidanylidene-ethyl] 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoate Openeye Name: [2-(2-benzhydrylidenehydrazino)-2-oxo-ethyl] 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoate CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]propanoic acid [2-[2-(diphenylmethylene)hydrazinyl]-2-oxoethyl] ester IUPAC Name: [2-(2-benzhydrylidenehydrazinyl)-2-oxoethyl] 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoate Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propionic acid [2-(N'-benzhydrylidenehydrazino)-2-keto-ethyl] ester Formula: C25H26N4O3S MolecularWeight: 462.56394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)OCC(=O)NN=C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)OCC(=O)NN=C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H26N4O3S/c1-17-21(18(2)27-25(26-17)33-3)14-15-23(31)32-16-22(30)28-29-24(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13H,14-16H2,1-3H3,(H,28,30)