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

Systemtic Name: 4-[5-[(2-methylphenyl)methylsulfanyl]-4-(2-methylprop-2-enyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-(2-methylallyl)-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(2-methylphenyl)methylthio]-4-(2-methylprop-2-enyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(2-methylphenyl)methylsulfanyl]-4-(2-methylprop-2-enyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-(2-methylallyl)-5-[(2-methylbenzyl)thio]-1,2,4-triazol-3-yl]pyridine Formula: C19H20N4S MolecularWeight: 336.4539

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2CC(=C)C)C3=CC=NC=C3

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2CC(=C)C)C3=CC=NC=C3

InChI

InChI=1S/C19H20N4S/c1-14(2)12-23-18(16-8-10-20-11-9-16)21-22-19(23)24-13-17-7-5-4-6-15(17)3/h4-11H,1,12-13H2,2-3H3