4-prop-2-enyl-2-propyl-5-pyridin-3-yl-1,2,4-triazol-3-one

Systemtic Name: 4-prop-2-enyl-2-propyl-5-pyridin-3-yl-1,2,4-triazol-3-one Openeye Name: 4-allyl-2-propyl-5-(3-pyridyl)-1,2,4-triazol-3-one CAS Name: 4-prop-2-enyl-2-propyl-5-(3-pyridinyl)-1,2,4-triazol-3-one IUPAC Name: 4-prop-2-enyl-2-propyl-5-pyridin-3-yl-1,2,4-triazol-3-one Traditional Name: 4-allyl-2-propyl-5-(3-pyridyl)-1,2,4-triazol-3-one Formula: C13H16N4O MolecularWeight: 244.29234

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)N(C(=N1)C2=CN=CC=C2)CC=C

Isomeric SMILES

CCCN1C(=O)N(C(=N1)C2=CN=CC=C2)CC=C

InChI

InChI=1S/C13H16N4O/c1-3-8-16-12(11-6-5-7-14-10-11)15-17(9-4-2)13(16)18/h3,5-7,10H,1,4,8-9H2,2H3