3-naphthalen-1-ylpropyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 3-naphthalen-1-ylpropyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 3-(1-naphthyl)propyl 4-(hydroxymethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-(1-naphthalenyl)propyl ester IUPAC Name: 3-naphthalen-1-ylpropyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-4-methylol-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-(1-naphthyl)propyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)CO)C(=O)OCCCC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=C(C(NC(=S)N1)CO)C(=O)OCCCC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C20H22N2O3S/c1-13-18(17(12-23)22-20(26)21-13)19(24)25-11-5-9-15-8-4-7-14-6-2-3-10-16(14)15/h2-4,6-8,10,17,23H,5,9,11-12H2,1H3,(H2,21,22,26)