2-methylpropyl 2-(6-methyl-2-octylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethanoate

Systemtic Name: 2-methylpropyl 2-(6-methyl-2-octylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethanoate Openeye Name: isobutyl 2-(6-methyl-2-octylsulfanyl-4-oxo-1H-pyrimidin-5-yl)acetate CAS Name: 2-[6-methyl-2-(octylthio)-4-oxo-1H-pyrimidin-5-yl]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(6-methyl-2-octylsulfanyl-4-oxo-1H-pyrimidin-5-yl)acetate Traditional Name: 2-[4-keto-6-methyl-2-(octylthio)-1H-pyrimidin-5-yl]acetic acid isobutyl ester Formula: C19H32N2O3S MolecularWeight: 368.53398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NC(=O)C(=C(N1)C)CC(=O)OCC(C)C

Isomeric SMILES

CCCCCCCCSC1=NC(=O)C(=C(N1)C)CC(=O)OCC(C)C

InChI

InChI=1S/C19H32N2O3S/c1-5-6-7-8-9-10-11-25-19-20-15(4)16(18(23)21-19)12-17(22)24-13-14(2)3/h14H,5-13H2,1-4H3,(H,20,21,23)