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

Systemtic Name: butyl 4-[2-(5-cyclopentyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)hydrazinyl]benzoate Openeye Name: butyl 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 butyl ester IUPAC Name: butyl 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 butyl ester Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NNC2=NC(=O)C(=C(N2)C)C3CCCC3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NNC2=NC(=O)C(=C(N2)C)C3CCCC3

InChI

InChI=1S/C21H28N4O3/c1-3-4-13-28-20(27)16-9-11-17(12-10-16)24-25-21-22-14(2)18(19(26)23-21)15-7-5-6-8-15/h9-12,15,24H,3-8,13H2,1-2H3,(H2,22,23,25,26)