(4-phenethylpiperidin-1-yl)-[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methanone

Systemtic Name: (4-phenethylpiperidin-1-yl)-[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methanone Openeye Name: (4-phenethyl-1-piperidyl)-[2-(1,2,4-triazol-1-yl)-3-pyridyl]methanone CAS Name: (4-phenethyl-1-piperidinyl)-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methanone IUPAC Name: (4-phenethylpiperidin-1-yl)-[2-(1,2,4-triazol-1-yl)pyridin-3-yl]methanone Traditional Name: (4-phenethylpiperidino)-[2-(1,2,4-triazol-1-yl)-3-pyridyl]methanone Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)N4C=NC=N4

Isomeric SMILES

C1CN(CCC1CCC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)N4C=NC=N4

InChI

InChI=1S/C21H23N5O/c27-21(19-7-4-12-23-20(19)26-16-22-15-24-26)25-13-10-18(11-14-25)9-8-17-5-2-1-3-6-17/h1-7,12,15-16,18H,8-11,13-14H2