4-(4-ethoxyphenyl)-3-[(1-methylpyrrol-2-yl)methyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(4-ethoxyphenyl)-3-[(1-methylpyrrol-2-yl)methyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-(4-ethoxyphenyl)-3-[(1-methylpyrrol-2-yl)methyl]-1H-1,2,4-triazol-5-one CAS Name: 4-(4-ethoxyphenyl)-3-[(1-methyl-2-pyrrolyl)methyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-(4-ethoxyphenyl)-3-[(1-methylpyrrol-2-yl)methyl]-1H-1,2,4-triazol-5-one Traditional Name: 3-[(1-methylpyrrol-2-yl)methyl]-4-p-phenetyl-1H-1,2,4-triazol-5-one Formula: C16H18N4O2 MolecularWeight: 298.33972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NNC2=O)CC3=CC=CN3C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NNC2=O)CC3=CC=CN3C

InChI

InChI=1S/C16H18N4O2/c1-3-22-14-8-6-12(7-9-14)20-15(17-18-16(20)21)11-13-5-4-10-19(13)2/h4-10H,3,11H2,1-2H3,(H,18,21)