methyl 3,4-bis(4-methoxyphenyl)-5-methylsulfanyl-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 3,4-bis(4-methoxyphenyl)-5-methylsulfanyl-1H-pyrrole-2-carboxylate Openeye Name: methyl 3,4-bis(4-methoxyphenyl)-5-methylsulfanyl-1H-pyrrole-2-carboxylate CAS Name: 3,4-bis(4-methoxyphenyl)-5-(methylthio)-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 3,4-bis(4-methoxyphenyl)-5-methylsulfanyl-1H-pyrrole-2-carboxylate Traditional Name: 3,4-bis(4-methoxyphenyl)-5-(methylthio)-1H-pyrrole-2-carboxylic acid methyl ester Formula: C21H21NO4S MolecularWeight: 383.46074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(NC(=C2C3=CC=C(C=C3)OC)SC)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(NC(=C2C3=CC=C(C=C3)OC)SC)C(=O)OC

InChI

InChI=1S/C21H21NO4S/c1-24-15-9-5-13(6-10-15)17-18(14-7-11-16(25-2)12-8-14)20(27-4)22-19(17)21(23)26-3/h5-12,22H,1-4H3