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

Systemtic Name: pentyl 4-[2-(5-butyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)hydrazinyl]benzoate Openeye Name: pentyl 4-[2-(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)hydrazino]benzoate CAS Name: 4-[(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)hydrazo]benzoic acid pentyl ester IUPAC Name: pentyl 4-[2-(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)hydrazinyl]benzoate Traditional Name: 4-[N'-(5-butyl-4-keto-6-methyl-1H-pyrimidin-2-yl)hydrazino]benzoic acid amyl ester Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NNC2=NC(=O)C(=C(N2)C)CCCC

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NNC2=NC(=O)C(=C(N2)C)CCCC

InChI

InChI=1S/C21H30N4O3/c1-4-6-8-14-28-20(27)16-10-12-17(13-11-16)24-25-21-22-15(3)18(9-7-5-2)19(26)23-21/h10-13,24H,4-9,14H2,1-3H3,(H2,22,23,25,26)