(E)-1-(5-azanyl-3-pyridin-3-yl-1,2,4-triazol-1-yl)-3-(4-methoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(5-azanyl-3-pyridin-3-yl-1,2,4-triazol-1-yl)-3-(4-methoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-[5-amino-3-(3-pyridyl)-1,2,4-triazol-1-yl]-3-(4-methoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-[5-amino-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-3-(4-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(5-amino-3-pyridin-3-yl-1,2,4-triazol-1-yl)-3-(4-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[5-amino-3-(3-pyridyl)-1,2,4-triazol-1-yl]-3-(4-methoxyphenyl)prop-2-en-1-one Formula: C17H15N5O2 MolecularWeight: 321.3333

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)N2C(=NC(=N2)C3=CN=CC=C3)N

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)N2C(=NC(=N2)C3=CN=CC=C3)N

InChI

InChI=1S/C17H15N5O2/c1-24-14-7-4-12(5-8-14)6-9-15(23)22-17(18)20-16(21-22)13-3-2-10-19-11-13/h2-11H,1H3,(H2,18,20,21)/b9-6+