2-methylpropyl (4S)-6-methyl-4-(4-propoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl (4S)-6-methyl-4-(4-propoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: isobutyl (4S)-6-methyl-4-(4-propoxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-methyl-4-(4-propoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (4S)-6-methyl-4-(4-propoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-methyl-4-(4-propoxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isobutyl ester Formula: C19H26N2O3S MolecularWeight: 362.48634

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2C(=C(NC(=S)N2)C)C(=O)OCC(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@H]2C(=C(NC(=S)N2)C)C(=O)OCC(C)C

InChI

InChI=1S/C19H26N2O3S/c1-5-10-23-15-8-6-14(7-9-15)17-16(13(4)20-19(25)21-17)18(22)24-11-12(2)3/h6-9,12,17H,5,10-11H2,1-4H3,(H2,20,21,25)/t17-/m0/s1