(4,5-diphenyl-1H-pyrrol-2-yl) thiocyanate

Systemtic Name: (4,5-diphenyl-1H-pyrrol-2-yl) thiocyanate Openeye Name: (4,5-diphenyl-1H-pyrrol-2-yl) thiocyanate CAS Name: thiocyanic acid (4,5-diphenyl-1H-pyrrol-2-yl) ester IUPAC Name: (4,5-diphenyl-1H-pyrrol-2-yl) thiocyanate Traditional Name: thiocyanic acid (4,5-diphenyl-1H-pyrrol-2-yl) ester Formula: C17H12N2S MolecularWeight: 276.35558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(NC(=C2)SC#N)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=C(NC(=C2)SC#N)C3=CC=CC=C3

InChI

InChI=1S/C17H12N2S/c18-12-20-16-11-15(13-7-3-1-4-8-13)17(19-16)14-9-5-2-6-10-14/h1-11,19H