propan-2-yl (4S)-4-(3-butoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2C(=C(NC(=S)N2)C)C(=O)OC(C)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)[C@H]2C(=C(NC(=S)N2)C)C(=O)OC(C)C

InChI

InChI=1S/C19H26N2O3S/c1-5-6-10-23-15-9-7-8-14(11-15)17-16(18(22)24-12(2)3)13(4)20-19(25)21-17/h7-9,11-12,17H,5-6,10H2,1-4H3,(H2,20,21,25)/t17-/m0/s1