2-methylpropyl 4-[2-[5-[(4-chlorophenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]hydrazinyl]benzoate

Systemtic Name: 2-methylpropyl 4-[2-[5-[(4-chlorophenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]hydrazinyl]benzoate Openeye Name: isobutyl 4-[2-[5-[(4-chlorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]hydrazino]benzoate CAS Name: 4-[[5-[(4-chlorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]hydrazo]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[2-[5-[(4-chlorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]hydrazinyl]benzoate Traditional Name: 4-[N'-[5-(4-chlorobenzyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]hydrazino]benzoic acid isobutyl ester Formula: C23H25ClN4O3 MolecularWeight: 440.9226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NNC2=CC=C(C=C2)C(=O)OCC(C)C)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NNC2=CC=C(C=C2)C(=O)OCC(C)C)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H25ClN4O3/c1-14(2)13-31-22(30)17-6-10-19(11-7-17)27-28-23-25-15(3)20(21(29)26-23)12-16-4-8-18(24)9-5-16/h4-11,14,27H,12-13H2,1-3H3,(H2,25,26,28,29)