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

Systemtic Name: 3-[(3-methylphenyl)methylsulfanyl]-5-[(4-methylphenyl)sulfanylmethyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-(m-tolylmethylsulfanyl)-5-(p-tolylsulfanylmethyl)-1,2,4-triazole CAS Name: 3-[(3-methylphenyl)methylthio]-5-[[(4-methylphenyl)thio]methyl]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(3-methylphenyl)methylsulfanyl]-5-[(4-methylphenyl)sulfanylmethyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(3-methylbenzyl)thio]-5-[(p-tolylthio)methyl]-1,2,4-triazole Formula: C21H23N3S2 MolecularWeight: 381.55742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=NN=C(N2CC=C)SCC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=NN=C(N2CC=C)SCC3=CC=CC(=C3)C

InChI

InChI=1S/C21H23N3S2/c1-4-12-24-20(15-25-19-10-8-16(2)9-11-19)22-23-21(24)26-14-18-7-5-6-17(3)13-18/h4-11,13H,1,12,14-15H2,2-3H3