3-(2,4-dichlorophenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(2,4-dichlorophenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(2,4-dichlorophenyl)-5-(m-tolylmethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-(2,4-dichlorophenyl)-5-[(3-methylphenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(2,4-dichlorophenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(2,4-dichlorophenyl)-5-[(3-methylbenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C16H14Cl2N4S MolecularWeight: 365.28016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2N)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2N)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H14Cl2N4S/c1-10-3-2-4-11(7-10)9-23-16-21-20-15(22(16)19)13-6-5-12(17)8-14(13)18/h2-8H,9,19H2,1H3