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

Systemtic Name: 3-(2,4-dichlorophenyl)-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(2,4-dichlorophenyl)-5-[(4-isopropylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(2,4-dichlorophenyl)-5-[(4-propan-2-ylphenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(2,4-dichlorophenyl)-5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(2,4-dichlorophenyl)-5-[(4-isopropylbenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C18H18Cl2N4S MolecularWeight: 393.33332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18Cl2N4S/c1-11(2)13-5-3-12(4-6-13)10-25-18-23-22-17(24(18)21)15-8-7-14(19)9-16(15)20/h3-9,11H,10,21H2,1-2H3