3-[(2-chlorophenyl)methylsulfanyl]-N-(phenylmethyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(2-chlorophenyl)methylsulfanyl]-N-(phenylmethyl)-1,2,4-triazol-4-amine Openeye Name: N-benzyl-3-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(2-chlorophenyl)methylthio]-N-(phenylmethyl)-1,2,4-triazol-4-amine IUPAC Name: N-benzyl-3-[(2-chlorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: benzyl-[3-[(2-chlorobenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C16H15ClN4S MolecularWeight: 330.8351

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNN2C=NN=C2SCC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CNN2C=NN=C2SCC3=CC=CC=C3Cl

InChI

InChI=1S/C16H15ClN4S/c17-15-9-5-4-8-14(15)11-22-16-20-18-12-21(16)19-10-13-6-2-1-3-7-13/h1-9,12,19H,10-11H2