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

Systemtic Name: methyl 3-[4-aminocarbonyl-5-methyl-3-(4-pyrrolidin-1-ylphenyl)-1-(2-thiophen-2-ylethyl)pyrrol-2-yl]propanoate Openeye Name: methyl 3-[4-carbamoyl-5-methyl-3-(4-pyrrolidin-1-ylphenyl)-1-[2-(2-thienyl)ethyl]pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-5-methyl-3-[4-(1-pyrrolidinyl)phenyl]-1-(2-thiophen-2-ylethyl)-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-5-methyl-3-(4-pyrrolidin-1-ylphenyl)-1-(2-thiophen-2-ylethyl)pyrrol-2-yl]propanoate Traditional Name: 3-[4-carbamoyl-5-methyl-3-(4-pyrrolidinophenyl)-1-[2-(2-thienyl)ethyl]pyrrol-2-yl]propionic acid methyl ester Formula: C26H31N3O3S MolecularWeight: 465.60764

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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)N4CCCC4)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CCC2=CC=CS2)CCC(=O)OC)C3=CC=C(C=C3)N4CCCC4)C(=O)N

InChI

InChI=1S/C26H31N3O3S/c1-18-24(26(27)31)25(19-7-9-20(10-8-19)28-14-3-4-15-28)22(11-12-23(30)32-2)29(18)16-13-21-6-5-17-33-21/h5-10,17H,3-4,11-16H2,1-2H3,(H2,27,31)