4-(2-methylphenyl)-3-(phenylmethylsulfanyl)-5-propan-2-yl-1,2,4-triazole

Systemtic Name: 4-(2-methylphenyl)-3-(phenylmethylsulfanyl)-5-propan-2-yl-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-5-isopropyl-4-(o-tolyl)-1,2,4-triazole CAS Name: 4-(2-methylphenyl)-3-(phenylmethylthio)-5-propan-2-yl-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-4-(2-methylphenyl)-5-propan-2-yl-1,2,4-triazole Traditional Name: 3-(benzylthio)-5-isopropyl-4-(o-tolyl)-1,2,4-triazole Formula: C19H21N3S MolecularWeight: 323.45514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SCC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SCC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C19H21N3S/c1-14(2)18-20-21-19(23-13-16-10-5-4-6-11-16)22(18)17-12-8-7-9-15(17)3/h4-12,14H,13H2,1-3H3