4-[2-(4-chloranylphenoxy)ethyl]-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-amine

Systemtic Name: 4-[2-(4-chloranylphenoxy)ethyl]-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-amine Openeye Name: 5-benzylsulfanyl-4-[2-(4-chlorophenoxy)ethyl]-1,2,4-triazol-3-amine CAS Name: 4-[2-(4-chlorophenoxy)ethyl]-5-(phenylmethylthio)-1,2,4-triazol-3-amine IUPAC Name: 5-benzylsulfanyl-4-[2-(4-chlorophenoxy)ethyl]-1,2,4-triazol-3-amine Traditional Name: [5-(benzylthio)-4-[2-(4-chlorophenoxy)ethyl]-1,2,4-triazol-3-yl]amine Formula: C17H17ClN4OS MolecularWeight: 360.86108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(N2CCOC3=CC=C(C=C3)Cl)N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(N2CCOC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C17H17ClN4OS/c18-14-6-8-15(9-7-14)23-11-10-22-16(19)20-21-17(22)24-12-13-4-2-1-3-5-13/h1-9H,10-12H2,(H2,19,20)