[1-(4-chlorophenyl)cyclopropyl]methyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: [1-(4-chlorophenyl)cyclopropyl]methyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: [1-(4-chlorophenyl)cyclopropyl]methyl 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 [1-(4-chlorophenyl)cyclopropyl]methyl ester IUPAC Name: [1-(4-chlorophenyl)cyclopropyl]methyl 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 [1-(4-chlorophenyl)cyclopropyl]methyl ester Formula: C17H19ClN2O3S MolecularWeight: 366.86236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)CO)C(=O)OCC2(CC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(NC(=S)N1)CO)C(=O)OCC2(CC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H19ClN2O3S/c1-10-14(13(8-21)20-16(24)19-10)15(22)23-9-17(6-7-17)11-2-4-12(18)5-3-11/h2-5,13,21H,6-9H2,1H3,(H2,19,20,24)