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

Systemtic Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1-phenylpyrazol-4-yl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OCC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OCC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C18H20N4O2S/c1-11-15(9-19-18(25)20-11)17(23)24-10-16-12(2)21-22(13(16)3)14-7-5-4-6-8-14/h4-8H,9-10H2,1-3H3,(H2,19,20,25)