1-(4-chlorophenyl)-3-(4-ethyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)pyridazin-4-one

Systemtic Name: 1-(4-chlorophenyl)-3-(4-ethyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)pyridazin-4-one Openeye Name: 3-(5-allylsulfanyl-4-ethyl-1,2,4-triazol-3-yl)-1-(4-chlorophenyl)pyridazin-4-one CAS Name: 1-(4-chlorophenyl)-3-[4-ethyl-5-(prop-2-enylthio)-1,2,4-triazol-3-yl]-4-pyridazinone IUPAC Name: 1-(4-chlorophenyl)-3-(4-ethyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)pyridazin-4-one Traditional Name: 3-[5-(allylthio)-4-ethyl-1,2,4-triazol-3-yl]-1-(4-chlorophenyl)pyridazin-4-one Formula: C17H16ClN5OS MolecularWeight: 373.85984

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC=C)C2=NN(C=CC2=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C(=NN=C1SCC=C)C2=NN(C=CC2=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H16ClN5OS/c1-3-11-25-17-20-19-16(22(17)4-2)15-14(24)9-10-23(21-15)13-7-5-12(18)6-8-13/h3,5-10H,1,4,11H2,2H3