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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC(=C(C=C3)Cl)Cl

InChI

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