4-[4-(4-methylphenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[4-(4-methylphenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-(2-methylallylsulfanyl)-4-(p-tolyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-(4-methylphenyl)-5-(2-methylprop-2-enylthio)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-(4-methylphenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-(2-methylallylthio)-4-(p-tolyl)-1,2,4-triazol-3-yl]pyridine Formula: C18H18N4S MolecularWeight: 322.42732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=C)C)C3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=C)C)C3=CC=NC=C3

InChI

InChI=1S/C18H18N4S/c1-13(2)12-23-18-21-20-17(15-8-10-19-11-9-15)22(18)16-6-4-14(3)5-7-16/h4-11H,1,12H2,2-3H3