5-methyl-4-(2-oxidanyl-3-phenylmethoxy-propyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-methyl-4-(2-oxidanyl-3-phenylmethoxy-propyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Openeye Name: 4-(3-benzyloxy-2-hydroxy-propyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-one CAS Name: 4-(2-hydroxy-3-phenylmethoxypropyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-one IUPAC Name: 4-(2-hydroxy-3-phenylmethoxypropyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Traditional Name: 4-(3-benzoxy-2-hydroxy-propyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-one Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N2C(=NC=N2)N1CC(COCC3=CC=CC=C3)O

Isomeric SMILES

CC1=CC(=O)N2C(=NC=N2)N1CC(COCC3=CC=CC=C3)O

InChI

InChI=1S/C16H18N4O3/c1-12-7-15(22)20-16(17-11-18-20)19(12)8-14(21)10-23-9-13-5-3-2-4-6-13/h2-7,11,14,21H,8-10H2,1H3