2-methoxyethyl (4S)-4-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl (4S)-4-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (4S)-4-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(5-cyano-1,2-dimethyl-3-pyrrolyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (4S)-4-(5-cyano-1,2-dimethylpyrrol-3-yl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(5-cyano-1,2-dimethyl-pyrrol-3-yl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=C(N(C(=C2)C#N)C)C)C(=O)OCCOC

Isomeric SMILES

CC1=C([C@@H](NC(=S)N1)C2=C(N(C(=C2)C#N)C)C)C(=O)OCCOC

InChI

InChI=1S/C16H20N4O3S/c1-9-13(15(21)23-6-5-22-4)14(19-16(24)18-9)12-7-11(8-17)20(3)10(12)2/h7,14H,5-6H2,1-4H3,(H2,18,19,24)/t14-/m0/s1