2-(3-chlorophenyl)-5-methyl-3-[(3-methylphenyl)methylsulfanyl]-1,3-dihydro-1,2,4-triazole

Systemtic Name: 2-(3-chlorophenyl)-5-methyl-3-[(3-methylphenyl)methylsulfanyl]-1,3-dihydro-1,2,4-triazole Openeye Name: 2-(3-chlorophenyl)-5-methyl-3-(m-tolylmethylsulfanyl)-1,3-dihydro-1,2,4-triazole CAS Name: 2-(3-chlorophenyl)-5-methyl-3-[(3-methylphenyl)methylthio]-1,3-dihydro-1,2,4-triazole IUPAC Name: 2-(3-chlorophenyl)-5-methyl-3-[(3-methylphenyl)methylsulfanyl]-1,3-dihydro-1,2,4-triazole Traditional Name: 2-(3-chlorophenyl)-5-methyl-3-[(3-methylbenzyl)thio]-1,3-dihydro-1,2,4-triazole Formula: C17H18ClN3S MolecularWeight: 331.86292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2N=C(NN2C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC(=CC=C1)CSC2N=C(NN2C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C17H18ClN3S/c1-12-5-3-6-14(9-12)11-22-17-19-13(2)20-21(17)16-8-4-7-15(18)10-16/h3-10,17H,11H2,1-2H3,(H,19,20)