(4-acetamido-2,5-diphenyl-1H-pyrrol-3-yl) thiocyanate

Systemtic Name: (4-acetamido-2,5-diphenyl-1H-pyrrol-3-yl) thiocyanate Openeye Name: (4-acetamido-2,5-diphenyl-1H-pyrrol-3-yl) thiocyanate CAS Name: thiocyanic acid (4-acetamido-2,5-diphenyl-1H-pyrrol-3-yl) ester IUPAC Name: (4-acetamido-2,5-diphenyl-1H-pyrrol-3-yl) thiocyanate Traditional Name: thiocyanic acid (4-acetamido-2,5-diphenyl-1H-pyrrol-3-yl) ester Formula: C19H15N3OS MolecularWeight: 333.4069

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(NC(=C1SC#N)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=C(NC(=C1SC#N)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H15N3OS/c1-13(23)21-18-16(14-8-4-2-5-9-14)22-17(19(18)24-12-20)15-10-6-3-7-11-15/h2-11,22H,1H3,(H,21,23)