[(1R,2S)-2-[2-oxidanylidene-6-(1,2,4-triazol-1-yl)-1,6-dihydropyrimidin-3-yl]cyclopropyl]methyl ethanoate

Systemtic Name: [(1R,2S)-2-[2-oxidanylidene-6-(1,2,4-triazol-1-yl)-1,6-dihydropyrimidin-3-yl]cyclopropyl]methyl ethanoate Openeye Name: [(1R,2S)-2-[2-oxo-6-(1,2,4-triazol-1-yl)-1,6-dihydropyrimidin-3-yl]cyclopropyl]methyl acetate CAS Name: acetic acid [(1R,2S)-2-[2-oxo-6-(1,2,4-triazol-1-yl)-1,6-dihydropyrimidin-3-yl]cyclopropyl]methyl ester IUPAC Name: [(1R,2S)-2-[2-oxo-6-(1,2,4-triazol-1-yl)-1,6-dihydropyrimidin-3-yl]cyclopropyl]methyl acetate Traditional Name: acetic acid [(1R,2S)-2-[2-keto-6-(1,2,4-triazol-1-yl)-1,6-dihydropyrimidin-3-yl]cyclopropyl]methyl ester Formula: C12H15N5O3 MolecularWeight: 277.2792

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1CC1N2C=CC(NC2=O)N3C=NC=N3

Isomeric SMILES

CC(=O)OC[C@@H]1C[C@@H]1N2C=CC(NC2=O)N3C=NC=N3

InChI

InChI=1S/C12H15N5O3/c1-8(18)20-5-9-4-10(9)16-3-2-11(15-12(16)19)17-7-13-6-14-17/h2-3,6-7,9-11H,4-5H2,1H3,(H,15,19)/t9-,10-,11?/m0/s1