(5Z)-3-heptyl-5-(4-methyl-3-methylsulfanyl-1H-1,2,4-triazol-5-ylidene)pyridin-4-one

Systemtic Name: (5Z)-3-heptyl-5-(4-methyl-3-methylsulfanyl-1H-1,2,4-triazol-5-ylidene)pyridin-4-one Openeye Name: (5Z)-3-heptyl-5-(4-methyl-3-methylsulfanyl-1H-1,2,4-triazol-5-ylidene)pyridin-4-one CAS Name: (5Z)-3-heptyl-5-[4-methyl-3-(methylthio)-1H-1,2,4-triazol-5-ylidene]-4-pyridinone IUPAC Name: (5Z)-3-heptyl-5-(4-methyl-3-methylsulfanyl-1H-1,2,4-triazol-5-ylidene)pyridin-4-one Traditional Name: (5Z)-3-heptyl-5-[4-methyl-3-(methylthio)-1H-1,2,4-triazol-5-ylidene]-4-pyridone Formula: C16H24N4OS MolecularWeight: 320.45296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=CC(=C2NN=C(N2C)SC)C1=O

Isomeric SMILES

CCCCCCCC1=CN=C/C(=C\2/NN=C(N2C)SC)/C1=O

InChI

InChI=1S/C16H24N4OS/c1-4-5-6-7-8-9-12-10-17-11-13(14(12)21)15-18-19-16(22-3)20(15)2/h10-11,18H,4-9H2,1-3H3/b15-13+