methyl 3-[4-aminocarbonyl-3-(4-cyanophenyl)-5-methyl-1-(2-thiophen-2-ylethyl)pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-3-(4-cyanophenyl)-5-methyl-1-(2-thiophen-2-ylethyl)pyrrol-2-yl]propanoate Openeye Name: methyl 3-[4-carbamoyl-3-(4-cyanophenyl)-5-methyl-1-[2-(2-thienyl)ethyl]pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-3-(4-cyanophenyl)-5-methyl-1-(2-thiophen-2-ylethyl)-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-3-(4-cyanophenyl)-5-methyl-1-(2-thiophen-2-ylethyl)pyrrol-2-yl]propanoate Traditional Name: 3-[4-carbamoyl-3-(4-cyanophenyl)-5-methyl-1-[2-(2-thienyl)ethyl]pyrrol-2-yl]propionic acid methyl ester Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CCC2=CC=CS2)CCC(=O)OC)C3=CC=C(C=C3)C#N)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CCC2=CC=CS2)CCC(=O)OC)C3=CC=C(C=C3)C#N)C(=O)N

InChI

InChI=1S/C23H23N3O3S/c1-15-21(23(25)28)22(17-7-5-16(14-24)6-8-17)19(9-10-20(27)29-2)26(15)12-11-18-4-3-13-30-18/h3-8,13H,9-12H2,1-2H3,(H2,25,28)