ethyl 5-[[(4-methoxyphenyl)methyl-(4-propan-2-ylphenyl)sulfonyl-amino]methyl]-3,4-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 5-[[(4-methoxyphenyl)methyl-(4-propan-2-ylphenyl)sulfonyl-amino]methyl]-3,4-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 5-[[(4-isopropylphenyl)sulfonyl-[(4-methoxyphenyl)methyl]amino]methyl]-3,4-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 5-[[(4-methoxyphenyl)methyl-(4-propan-2-ylphenyl)sulfonylamino]methyl]-3,4-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[(4-methoxyphenyl)methyl-(4-propan-2-ylphenyl)sulfonylamino]methyl]-3,4-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 3,4-dimethyl-5-[[p-anisyl(p-cumenylsulfonyl)amino]methyl]-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C27H34N2O5S MolecularWeight: 498.63426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)CN(CC2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)C(C)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)CN(CC2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)C(C)C)C)C

InChI

InChI=1S/C27H34N2O5S/c1-7-34-27(30)26-20(5)19(4)25(28-26)17-29(16-21-8-12-23(33-6)13-9-21)35(31,32)24-14-10-22(11-15-24)18(2)3/h8-15,18,28H,7,16-17H2,1-6H3