3-methyl-5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-methyl-5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-methyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-methyl-5-[(4-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-methyl-5-[(4-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-methyl-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)C

InChI

InChI=1S/C14H17N3S/c1-4-9-17-12(3)15-16-14(17)18-10-13-7-5-11(2)6-8-13/h4-8H,1,9-10H2,2-3H3