5-methoxy-2-methyl-4-[(2-methyl-5-pyrimidin-2-yl-phenyl)methyl]-1,2,4-triazol-3-one

Systemtic Name: 5-methoxy-2-methyl-4-[(2-methyl-5-pyrimidin-2-yl-phenyl)methyl]-1,2,4-triazol-3-one Openeye Name: 5-methoxy-2-methyl-4-[(2-methyl-5-pyrimidin-2-yl-phenyl)methyl]-1,2,4-triazol-3-one CAS Name: 5-methoxy-2-methyl-4-[[2-methyl-5-(2-pyrimidinyl)phenyl]methyl]-1,2,4-triazol-3-one IUPAC Name: 5-methoxy-2-methyl-4-[(2-methyl-5-pyrimidin-2-ylphenyl)methyl]-1,2,4-triazol-3-one Traditional Name: 5-methoxy-2-methyl-4-[2-methyl-5-(2-pyrimidyl)benzyl]-1,2,4-triazol-3-one Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC=CC=N2)CN3C(=NN(C3=O)C)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC=CC=N2)CN3C(=NN(C3=O)C)OC

InChI

InChI=1S/C16H17N5O2/c1-11-5-6-12(14-17-7-4-8-18-14)9-13(11)10-21-15(23-3)19-20(2)16(21)22/h4-9H,10H2,1-3H3