methyl 2-(2,5-dimethylpyrrol-1-yl)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(2,5-dimethylpyrrol-1-yl)-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-(2,5-dimethylpyrrol-1-yl)-4-phenyl-thiophene-3-carboxylate CAS Name: 2-(2,5-dimethyl-1-pyrrolyl)-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(2,5-dimethylpyrrol-1-yl)-4-phenylthiophene-3-carboxylate Traditional Name: 2-(2,5-dimethylpyrrol-1-yl)-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C18H17NO2S MolecularWeight: 311.39808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC)C

Isomeric SMILES

CC1=CC=C(N1C2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC)C

InChI

InChI=1S/C18H17NO2S/c1-12-9-10-13(2)19(12)17-16(18(20)21-3)15(11-22-17)14-7-5-4-6-8-14/h4-11H,1-3H3