2-methoxy-1-[5-[(phenylmethyl)amino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]ethanone

Systemtic Name: 2-methoxy-1-[5-[(phenylmethyl)amino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]ethanone Openeye Name: 1-[5-(benzylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-2-methoxy-ethanone CAS Name: 2-methoxy-1-[5-[(phenylmethyl)amino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]ethanone IUPAC Name: 1-[5-(benzylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-2-methoxyethanone Traditional Name: 1-[5-(benzylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-2-methoxy-ethanone Formula: C17H17N5O2 MolecularWeight: 323.34918

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1C(=NC(=N1)C2=CN=CC=C2)NCC3=CC=CC=C3

Isomeric SMILES

COCC(=O)N1C(=NC(=N1)C2=CN=CC=C2)NCC3=CC=CC=C3

InChI

InChI=1S/C17H17N5O2/c1-24-12-15(23)22-17(19-10-13-6-3-2-4-7-13)20-16(21-22)14-8-5-9-18-11-14/h2-9,11H,10,12H2,1H3,(H,19,20,21)