methyl 4-methyl-6-phenyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 4-methyl-6-phenyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 4-methyl-6-phenyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-6-phenyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-methyl-6-phenyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-methyl-6-phenyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=S)C2=CC=CC=C2)C(=O)OC)C

Isomeric SMILES

CCCN1C(=C(C(NC1=S)C2=CC=CC=C2)C(=O)OC)C

InChI

InChI=1S/C16H20N2O2S/c1-4-10-18-11(2)13(15(19)20-3)14(17-16(18)21)12-8-6-5-7-9-12/h5-9,14H,4,10H2,1-3H3,(H,17,21)