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

Systemtic Name: methyl 3-[4-aminocarbonyl-3-(4-tert-butylphenyl)-5-methyl-1-(2-thiophen-2-ylethyl)pyrrol-2-yl]propanoate Openeye Name: methyl 3-[3-(4-tert-butylphenyl)-4-carbamoyl-5-methyl-1-[2-(2-thienyl)ethyl]pyrrol-2-yl]propanoate CAS Name: 3-[3-(4-tert-butylphenyl)-4-carbamoyl-5-methyl-1-(2-thiophen-2-ylethyl)-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-(4-tert-butylphenyl)-4-carbamoyl-5-methyl-1-(2-thiophen-2-ylethyl)pyrrol-2-yl]propanoate Traditional Name: 3-[3-(4-tert-butylphenyl)-4-carbamoyl-5-methyl-1-[2-(2-thienyl)ethyl]pyrrol-2-yl]propionic acid methyl ester Formula: C26H32N2O3S MolecularWeight: 452.60888

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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(C)(C)C)C(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C26H32N2O3S/c1-17-23(25(27)30)24(18-8-10-19(11-9-18)26(2,3)4)21(12-13-22(29)31-5)28(17)15-14-20-7-6-16-32-20/h6-11,16H,12-15H2,1-5H3,(H2,27,30)