5-[(4-butoxyphenyl)methyl]-6-(ethoxymethyl)-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-butoxyphenyl)methyl]-6-(ethoxymethyl)-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-[(4-butoxyphenyl)methyl]-6-(ethoxymethyl)-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-[(4-butoxyphenyl)methyl]-6-(ethoxymethyl)-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-[(4-butoxyphenyl)methyl]-6-(ethoxymethyl)-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-(4-butoxybenzyl)-6-(ethoxymethyl)-2-thioxo-1H-pyrimidin-4-one Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CC2=C(NC(=S)NC2=O)COCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CC2=C(NC(=S)NC2=O)COCC

InChI

InChI=1S/C18H24N2O3S/c1-3-5-10-23-14-8-6-13(7-9-14)11-15-16(12-22-4-2)19-18(24)20-17(15)21/h6-9H,3-5,10-12H2,1-2H3,(H2,19,20,21,24)