1-hepta-1,6-dien-4-yl-4-(1,2,4-triazol-1-yl)pyrimidin-2-one

Systemtic Name: 1-hepta-1,6-dien-4-yl-4-(1,2,4-triazol-1-yl)pyrimidin-2-one Openeye Name: 1-(1-allylbut-3-enyl)-4-(1,2,4-triazol-1-yl)pyrimidin-2-one CAS Name: 1-hepta-1,6-dien-4-yl-4-(1,2,4-triazol-1-yl)-2-pyrimidinone IUPAC Name: 1-hepta-1,6-dien-4-yl-4-(1,2,4-triazol-1-yl)pyrimidin-2-one Traditional Name: 1-(1-allylbut-3-enyl)-4-(1,2,4-triazol-1-yl)pyrimidin-2-one Formula: C13H15N5O MolecularWeight: 257.2911

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC=C)N1C=CC(=NC1=O)N2C=NC=N2

Isomeric SMILES

C=CCC(CC=C)N1C=CC(=NC1=O)N2C=NC=N2

InChI

InChI=1S/C13H15N5O/c1-3-5-11(6-4-2)17-8-7-12(16-13(17)19)18-10-14-9-15-18/h3-4,7-11H,1-2,5-6H2