3-ethoxy-1-(4-isothiocyanatophenyl)-1,2,4-triazole

Systemtic Name: 3-ethoxy-1-(4-isothiocyanatophenyl)-1,2,4-triazole Openeye Name: 3-ethoxy-1-(4-isothiocyanatophenyl)-1,2,4-triazole CAS Name: 3-ethoxy-1-(4-isothiocyanatophenyl)-1,2,4-triazole IUPAC Name: 3-ethoxy-1-(4-isothiocyanatophenyl)-1,2,4-triazole Traditional Name: 3-ethoxy-1-(4-isothiocyanatophenyl)-1,2,4-triazole Formula: C11H10N4OS MolecularWeight: 246.2883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C=N1)C2=CC=C(C=C2)N=C=S

Isomeric SMILES

CCOC1=NN(C=N1)C2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C11H10N4OS/c1-2-16-11-12-7-15(14-11)10-5-3-9(4-6-10)13-8-17/h3-7H,2H2,1H3