ethyl 6-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanylmethyl]-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanylmethyl]-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]sulfanylmethyl]-2-oxo-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]thio]methyl]-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanylmethyl]-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]thio]methyl]-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H27N5O3S2 MolecularWeight: 497.63288

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC2=C(C(NC(=O)N2)C3=CC=CS3)C(=O)OCC)C4=CC(=CC=C4)C

Isomeric SMILES

CCCN1C(=NN=C1SCC2=C(C(NC(=O)N2)C3=CC=CS3)C(=O)OCC)C4=CC(=CC=C4)C

InChI

InChI=1S/C24H27N5O3S2/c1-4-11-29-21(16-9-6-8-15(3)13-16)27-28-24(29)34-14-17-19(22(30)32-5-2)20(26-23(31)25-17)18-10-7-12-33-18/h6-10,12-13,20H,4-5,11,14H2,1-3H3,(H2,25,26,31)