3-[(2-chlorophenyl)methylsulfanyl]-5-(4-ethoxyphenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(2-chlorophenyl)methylsulfanyl]-5-(4-ethoxyphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(2-chlorophenyl)methylsulfanyl]-5-(4-ethoxyphenyl)-1,2,4-triazol-4-amine CAS Name: 3-[(2-chlorophenyl)methylthio]-5-(4-ethoxyphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(2-chlorophenyl)methylsulfanyl]-5-(4-ethoxyphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(2-chlorobenzyl)thio]-5-p-phenetyl-1,2,4-triazol-4-yl]amine Formula: C17H17ClN4OS MolecularWeight: 360.86108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC=CC=C3Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C17H17ClN4OS/c1-2-23-14-9-7-12(8-10-14)16-20-21-17(22(16)19)24-11-13-5-3-4-6-15(13)18/h3-10H,2,11,19H2,1H3