4-[(4-chlorophenyl)methyl]-5-phenethylsulfanyl-1,2,4-triazol-3-amine

Systemtic Name: 4-[(4-chlorophenyl)methyl]-5-phenethylsulfanyl-1,2,4-triazol-3-amine Openeye Name: 4-[(4-chlorophenyl)methyl]-5-phenethylsulfanyl-1,2,4-triazol-3-amine CAS Name: 4-[(4-chlorophenyl)methyl]-5-(phenethylthio)-1,2,4-triazol-3-amine IUPAC Name: 4-[(4-chlorophenyl)methyl]-5-phenethylsulfanyl-1,2,4-triazol-3-amine Traditional Name: [4-(4-chlorobenzyl)-5-(phenethylthio)-1,2,4-triazol-3-yl]amine Formula: C17H17ClN4S MolecularWeight: 344.86168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NN=C(N2CC3=CC=C(C=C3)Cl)N

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NN=C(N2CC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C17H17ClN4S/c18-15-8-6-14(7-9-15)12-22-16(19)20-21-17(22)23-11-10-13-4-2-1-3-5-13/h1-9H,10-12H2,(H2,19,20)