3-(2-methoxyphenyl)-1-[4-(1H-1,2,4-triazol-5-ylcarbonyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(2-methoxyphenyl)-1-[4-(1H-1,2,4-triazol-5-ylcarbonyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(2-methoxyphenyl)-1-[4-(1H-1,2,4-triazole-5-carbonyl)piperazin-1-yl]propan-1-one CAS Name: 3-(2-methoxyphenyl)-1-[4-[oxo(1H-1,2,4-triazol-5-yl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(2-methoxyphenyl)-1-[4-(1H-1,2,4-triazole-5-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(2-methoxyphenyl)-1-[4-(1H-1,2,4-triazole-5-carbonyl)piperazino]propan-1-one Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCC(=O)N2CCN(CC2)C(=O)C3=NC=NN3

Isomeric SMILES

COC1=CC=CC=C1CCC(=O)N2CCN(CC2)C(=O)C3=NC=NN3

InChI

InChI=1S/C17H21N5O3/c1-25-14-5-3-2-4-13(14)6-7-15(23)21-8-10-22(11-9-21)17(24)16-18-12-19-20-16/h2-5,12H,6-11H2,1H3,(H,18,19,20)