2-(4-methoxyphenyl)-1-[3-(3-pyridin-3-yl-1H-1,2,4-triazol-5-yl)piperidin-1-yl]ethanone

Systemtic Name: 2-(4-methoxyphenyl)-1-[3-(3-pyridin-3-yl-1H-1,2,4-triazol-5-yl)piperidin-1-yl]ethanone Openeye Name: 2-(4-methoxyphenyl)-1-[3-[3-(3-pyridyl)-1H-1,2,4-triazol-5-yl]-1-piperidyl]ethanone CAS Name: 2-(4-methoxyphenyl)-1-[3-[3-(3-pyridinyl)-1H-1,2,4-triazol-5-yl]-1-piperidinyl]ethanone IUPAC Name: 2-(4-methoxyphenyl)-1-[3-(3-pyridin-3-yl-1H-1,2,4-triazol-5-yl)piperidin-1-yl]ethanone Traditional Name: 2-(4-methoxyphenyl)-1-[3-[3-(3-pyridyl)-1H-1,2,4-triazol-5-yl]piperidino]ethanone Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)N2CCCC(C2)C3=NC(=NN3)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)N2CCCC(C2)C3=NC(=NN3)C4=CN=CC=C4

InChI

InChI=1S/C21H23N5O2/c1-28-18-8-6-15(7-9-18)12-19(27)26-11-3-5-17(14-26)21-23-20(24-25-21)16-4-2-10-22-13-16/h2,4,6-10,13,17H,3,5,11-12,14H2,1H3,(H,23,24,25)