methyl 6-[3-fluoranyl-4-(1,2,4-triazol-1-yl)phenyl]-4-methyl-2-oxidanylidene-3-propyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 6-[3-fluoranyl-4-(1,2,4-triazol-1-yl)phenyl]-4-methyl-2-oxidanylidene-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 6-[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-fluoro-4-(1,2,4-triazol-1-yl)phenyl]-2-keto-4-methyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C18H20FN5O3 MolecularWeight: 373.381503

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC(=C(C=C2)N3C=NC=N3)F)C(=O)OC)C

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=C(C=C2)N3C=NC=N3)F)C(=O)OC)C

InChI

InChI=1S/C18H20FN5O3/c1-4-7-23-11(2)15(17(25)27-3)16(22-18(23)26)12-5-6-14(13(19)8-12)24-10-20-9-21-24/h5-6,8-10,16H,4,7H2,1-3H3,(H,22,26)