N-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-pyrrol-2-yl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-pyrrol-2-yl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-pyrrol-2-yl]-2-(2-thienyl)acetamide CAS Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-2-pyrrolyl]-2-thiophen-2-ylacetamide IUPAC Name: N-[3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenylpyrrol-2-yl]-2-thiophen-2-ylacetamide Traditional Name: N-(3-cyano-1-p-anisyl-4,5-diphenyl-pyrrol-2-yl)-2-(2-thienyl)acetamide Formula: C31H25N3O2S MolecularWeight: 503.6141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=C(C(=C2NC(=O)CC3=CC=CS3)C#N)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=C(C(=C2NC(=O)CC3=CC=CS3)C#N)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H25N3O2S/c1-36-25-16-14-22(15-17-25)21-34-30(24-11-6-3-7-12-24)29(23-9-4-2-5-10-23)27(20-32)31(34)33-28(35)19-26-13-8-18-37-26/h2-18H,19,21H2,1H3,(H,33,35)