methyl 3-cyclopropyl-2-oxidanylidene-6-phenyl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 3-cyclopropyl-2-oxidanylidene-6-phenyl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-cyclopropyl-2-oxo-6-phenyl-4-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-cyclopropyl-2-oxo-6-phenyl-4-[[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]methyl]-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-cyclopropyl-2-oxo-6-phenyl-4-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-cyclopropyl-2-keto-6-phenyl-4-[[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C23H21N5O4S MolecularWeight: 463.50894

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2)C3CC3)CSC4=NN=C(O4)C5=CC=NC=C5

Isomeric SMILES

COC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2)C3CC3)CSC4=NN=C(O4)C5=CC=NC=C5

InChI

InChI=1S/C23H21N5O4S/c1-31-21(29)18-17(13-33-23-27-26-20(32-23)15-9-11-24-12-10-15)28(16-7-8-16)22(30)25-19(18)14-5-3-2-4-6-14/h2-6,9-12,16,19H,7-8,13H2,1H3,(H,25,30)