ethyl 4-(3,4-dimethoxyphenyl)-1-(phenylmethyl)-3-(thiophen-2-ylcarbonylamino)pyrrole-2-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-1-(phenylmethyl)-3-(thiophen-2-ylcarbonylamino)pyrrole-2-carboxylate Openeye Name: ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(thiophene-2-carbonylamino)pyrrole-2-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-3-[[oxo(thiophen-2-yl)methyl]amino]-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(thiophene-2-carbonylamino)pyrrole-2-carboxylate Traditional Name: 1-benzyl-4-(3,4-dimethoxyphenyl)-3-(2-thenoylamino)pyrrole-2-carboxylic acid ethyl ester Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN1CC2=CC=CC=C2)C3=CC(=C(C=C3)OC)OC)NC(=O)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1CC2=CC=CC=C2)C3=CC(=C(C=C3)OC)OC)NC(=O)C4=CC=CS4

InChI

InChI=1S/C27H26N2O5S/c1-4-34-27(31)25-24(28-26(30)23-11-8-14-35-23)20(17-29(25)16-18-9-6-5-7-10-18)19-12-13-21(32-2)22(15-19)33-3/h5-15,17H,4,16H2,1-3H3,(H,28,30)