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

Systemtic Name: 3-(3-methylphenyl)-5-[(2-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-(m-tolyl)-5-(o-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(3-methylphenyl)-5-[(2-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-(3-methylphenyl)-5-[(2-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(2-methylbenzyl)thio]-5-(m-tolyl)-1,2,4-triazole Formula: C20H21N3S MolecularWeight: 335.46584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC3=CC=CC=C3C

InChI

InChI=1S/C20H21N3S/c1-4-12-23-19(17-11-7-8-15(2)13-17)21-22-20(23)24-14-18-10-6-5-9-16(18)3/h4-11,13H,1,12,14H2,2-3H3