methyl 4-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methyl-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 4-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methyl-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 4-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[[[4-amino-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]methyl]-3-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-[[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]thio]methyl]-2-keto-3-methyl-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C20H20N6O4S MolecularWeight: 440.4756

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(NC1=O)C2=CC=CC=C2)C(=O)OC)CSC3=NN=C(N3N)C4=CC=CO4

Isomeric SMILES

CN1C(=C(C(NC1=O)C2=CC=CC=C2)C(=O)OC)CSC3=NN=C(N3N)C4=CC=CO4

InChI

InChI=1S/C20H20N6O4S/c1-25-13(11-31-20-24-23-17(26(20)21)14-9-6-10-30-14)15(18(27)29-2)16(22-19(25)28)12-7-4-3-5-8-12/h3-10,16H,11,21H2,1-2H3,(H,22,28)