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

Systemtic Name: methyl (4S)-6-methyl-4-(5-phenylthiophen-2-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-6-methyl-4-(5-phenyl-2-thienyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-methyl-4-(5-phenyl-2-thiophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-6-methyl-4-(5-phenylthiophen-2-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-methyl-4-(5-phenyl-2-thienyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C17H16N2O2S2 MolecularWeight: 344.45114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC=C(S2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1)C2=CC=C(S2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C17H16N2O2S2/c1-10-14(16(20)21-2)15(19-17(22)18-10)13-9-8-12(23-13)11-6-4-3-5-7-11/h3-9,15H,1-2H3,(H2,18,19,22)/t15-/m1/s1