5-ethyl-6-[(3-prop-2-enoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-ethyl-6-[(3-prop-2-enoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 6-[(3-allyloxyphenyl)methyl]-5-ethyl-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-ethyl-6-[(3-prop-2-enoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-ethyl-6-[(3-prop-2-enoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 6-(3-allyloxybenzyl)-5-ethyl-2-thioxo-1H-pyrimidin-4-one Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=S)NC1=O)CC2=CC(=CC=C2)OCC=C

Isomeric SMILES

CCC1=C(NC(=S)NC1=O)CC2=CC(=CC=C2)OCC=C

InChI

InChI=1S/C16H18N2O2S/c1-3-8-20-12-7-5-6-11(9-12)10-14-13(4-2)15(19)18-16(21)17-14/h3,5-7,9H,1,4,8,10H2,2H3,(H2,17,18,19,21)