methyl 6-methyl-4-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 6-methyl-4-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 6-methyl-4-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-4-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-methyl-4-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-4-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C20H18N4O2S2/c1-12-16(19(25)26-2)18(22-20(27)21-12)14-11-24(13-7-4-3-5-8-13)23-17(14)15-9-6-10-28-15/h3-11,18H,1-2H3,(H2,21,22,27)