methyl 2-[[6-(naphthalen-1-ylmethyl)-4-oxidanylidene-5-propan-2-yl-1H-pyrimidin-2-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[6-(naphthalen-1-ylmethyl)-4-oxidanylidene-5-propan-2-yl-1H-pyrimidin-2-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[[5-isopropyl-6-(1-naphthylmethyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]acetate CAS Name: 2-[[6-(1-naphthalenylmethyl)-4-oxo-5-propan-2-yl-1H-pyrimidin-2-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[[6-(naphthalen-1-ylmethyl)-4-oxo-5-propan-2-yl-1H-pyrimidin-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-isopropyl-4-keto-6-(1-naphthylmethyl)-1H-pyrimidin-2-yl]thio]acetic acid methyl ester Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(NC(=NC1=O)SCC(=O)OC)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)C1=C(NC(=NC1=O)SCC(=O)OC)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C21H22N2O3S/c1-13(2)19-17(22-21(23-20(19)25)27-12-18(24)26-3)11-15-9-6-8-14-7-4-5-10-16(14)15/h4-10,13H,11-12H2,1-3H3,(H,22,23,25)