2-ethylsulfanylethyl (4S)-4-(4-ethylphenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-ethylsulfanylethyl (4S)-4-(4-ethylphenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 2-ethylsulfanylethyl (4S)-4-(4-ethylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(4-ethylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(ethylthio)ethyl ester IUPAC Name: 2-ethylsulfanylethyl (4S)-4-(4-ethylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(4-ethylphenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-(ethylthio)ethyl ester Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C(=C(NC(=O)N2)C)C(=O)OCCSCC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H]2C(=C(NC(=O)N2)C)C(=O)OCCSCC

InChI

InChI=1S/C18H24N2O3S/c1-4-13-6-8-14(9-7-13)16-15(12(3)19-18(22)20-16)17(21)23-10-11-24-5-2/h6-9,16H,4-5,10-11H2,1-3H3,(H2,19,20,22)/t16-/m0/s1