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

Systemtic Name: 2-methylpropyl 4-[2-(5-cyclopentyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)hydrazinyl]benzoate Openeye Name: isobutyl 4-[2-(5-cyclopentyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)hydrazino]benzoate CAS Name: 4-[(5-cyclopentyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)hydrazo]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[2-(5-cyclopentyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)hydrazinyl]benzoate Traditional Name: 4-[N'-(5-cyclopentyl-4-keto-6-methyl-1H-pyrimidin-2-yl)hydrazino]benzoic acid isobutyl ester Formula: C21H28N4O3 MolecularWeight: 384.47202

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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)C3CCCC3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NNC2=CC=C(C=C2)C(=O)OCC(C)C)C3CCCC3

InChI

InChI=1S/C21H28N4O3/c1-13(2)12-28-20(27)16-8-10-17(11-9-16)24-25-21-22-14(3)18(19(26)23-21)15-6-4-5-7-15/h8-11,13,15,24H,4-7,12H2,1-3H3,(H2,22,23,25,26)