3-methylbutyl 4-[2-[6-methyl-5-(naphthalen-1-ylmethyl)-4-oxidanylidene-1H-pyrimidin-2-yl]hydrazinyl]benzoate

Systemtic Name: 3-methylbutyl 4-[2-[6-methyl-5-(naphthalen-1-ylmethyl)-4-oxidanylidene-1H-pyrimidin-2-yl]hydrazinyl]benzoate Openeye Name: isopentyl 4-[2-[6-methyl-5-(1-naphthylmethyl)-4-oxo-1H-pyrimidin-2-yl]hydrazino]benzoate CAS Name: 4-[[6-methyl-5-(1-naphthalenylmethyl)-4-oxo-1H-pyrimidin-2-yl]hydrazo]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[2-[6-methyl-5-(naphthalen-1-ylmethyl)-4-oxo-1H-pyrimidin-2-yl]hydrazinyl]benzoate Traditional Name: 4-[N'-[4-keto-6-methyl-5-(1-naphthylmethyl)-1H-pyrimidin-2-yl]hydrazino]benzoic acid isoamyl ester Formula: C28H30N4O3 MolecularWeight: 470.5628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NNC2=CC=C(C=C2)C(=O)OCCC(C)C)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NNC2=CC=C(C=C2)C(=O)OCCC(C)C)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H30N4O3/c1-18(2)15-16-35-27(34)21-11-13-23(14-12-21)31-32-28-29-19(3)25(26(33)30-28)17-22-9-6-8-20-7-4-5-10-24(20)22/h4-14,18,31H,15-17H2,1-3H3,(H2,29,30,32,33)