ethyl 5-(4-methoxyphenyl)-2-methyl-1-[3-oxidanylidene-3-(thiophen-2-ylmethylamino)propyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(4-methoxyphenyl)-2-methyl-1-[3-oxidanylidene-3-(thiophen-2-ylmethylamino)propyl]pyrrole-3-carboxylate Openeye Name: ethyl 5-(4-methoxyphenyl)-2-methyl-1-[3-oxo-3-(2-thienylmethylamino)propyl]pyrrole-3-carboxylate CAS Name: 5-(4-methoxyphenyl)-2-methyl-1-[3-oxo-3-(thiophen-2-ylmethylamino)propyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-methoxyphenyl)-2-methyl-1-[3-oxo-3-(thiophen-2-ylmethylamino)propyl]pyrrole-3-carboxylate Traditional Name: 1-[3-keto-3-(2-thenylamino)propyl]-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)OC)CCC(=O)NCC3=CC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)OC)CCC(=O)NCC3=CC=CS3)C

InChI

InChI=1S/C23H26N2O4S/c1-4-29-23(27)20-14-21(17-7-9-18(28-3)10-8-17)25(16(20)2)12-11-22(26)24-15-19-6-5-13-30-19/h5-10,13-14H,4,11-12,15H2,1-3H3,(H,24,26)