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

Systemtic Name: methyl 3-[4-aminocarbonyl-1-[(3-chlorophenyl)methyl]-5-methyl-3-thiophen-2-yl-pyrrol-2-yl]propanoate Openeye Name: methyl 3-[4-carbamoyl-1-[(3-chlorophenyl)methyl]-5-methyl-3-(2-thienyl)pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-1-[(3-chlorophenyl)methyl]-5-methyl-3-thiophen-2-yl-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-1-[(3-chlorophenyl)methyl]-5-methyl-3-thiophen-2-ylpyrrol-2-yl]propanoate Traditional Name: 3-[4-carbamoyl-1-(3-chlorobenzyl)-5-methyl-3-(2-thienyl)pyrrol-2-yl]propionic acid methyl ester Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)CCC(=O)OC)C3=CC=CS3)C(=O)N

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)CCC(=O)OC)C3=CC=CS3)C(=O)N

InChI

InChI=1S/C21H21ClN2O3S/c1-13-19(21(23)26)20(17-7-4-10-28-17)16(8-9-18(25)27-2)24(13)12-14-5-3-6-15(22)11-14/h3-7,10-11H,8-9,12H2,1-2H3,(H2,23,26)