[2-[3-ethyl-5-(piperidin-1-ylmethyl)-1,2,4-triazol-4-yl]phenyl]-pyridin-2-yl-methanone

Systemtic Name: [2-[3-ethyl-5-(piperidin-1-ylmethyl)-1,2,4-triazol-4-yl]phenyl]-pyridin-2-yl-methanone Openeye Name: [2-[3-ethyl-5-(1-piperidylmethyl)-1,2,4-triazol-4-yl]phenyl]-(2-pyridyl)methanone CAS Name: [2-[3-ethyl-5-(1-piperidinylmethyl)-1,2,4-triazol-4-yl]phenyl]-(2-pyridinyl)methanone IUPAC Name: [2-[3-ethyl-5-(piperidin-1-ylmethyl)-1,2,4-triazol-4-yl]phenyl]-pyridin-2-ylmethanone Traditional Name: [2-[3-ethyl-5-(piperidinomethyl)-1,2,4-triazol-4-yl]phenyl]-(2-pyridyl)methanone Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC=C2C(=O)C3=CC=CC=N3)CN4CCCCC4

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC=C2C(=O)C3=CC=CC=N3)CN4CCCCC4

InChI

InChI=1S/C22H25N5O/c1-2-20-24-25-21(16-26-14-8-3-9-15-26)27(20)19-12-5-4-10-17(19)22(28)18-11-6-7-13-23-18/h4-7,10-13H,2-3,8-9,14-16H2,1H3