ethyl 3-[1-(4-aminocarbonyl-2-methyl-phenyl)-5-[4-(2-methylimidazol-1-yl)phenyl]pyrrol-2-yl]propanoate

Systemtic Name: ethyl 3-[1-(4-aminocarbonyl-2-methyl-phenyl)-5-[4-(2-methylimidazol-1-yl)phenyl]pyrrol-2-yl]propanoate Openeye Name: ethyl 3-[1-(4-carbamoyl-2-methyl-phenyl)-5-[4-(2-methylimidazol-1-yl)phenyl]pyrrol-2-yl]propanoate CAS Name: 3-[1-(4-carbamoyl-2-methylphenyl)-5-[4-(2-methyl-1-imidazolyl)phenyl]-2-pyrrolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[1-(4-carbamoyl-2-methylphenyl)-5-[4-(2-methylimidazol-1-yl)phenyl]pyrrol-2-yl]propanoate Traditional Name: 3-[1-(4-carbamoyl-2-methyl-phenyl)-5-[4-(2-methylimidazol-1-yl)phenyl]pyrrol-2-yl]propionic acid ethyl ester Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC=C(N1C2=C(C=C(C=C2)C(=O)N)C)C3=CC=C(C=C3)N4C=CN=C4C

Isomeric SMILES

CCOC(=O)CCC1=CC=C(N1C2=C(C=C(C=C2)C(=O)N)C)C3=CC=C(C=C3)N4C=CN=C4C

InChI

InChI=1S/C27H28N4O3/c1-4-34-26(32)14-11-23-10-13-25(31(23)24-12-7-21(27(28)33)17-18(24)2)20-5-8-22(9-6-20)30-16-15-29-19(30)3/h5-10,12-13,15-17H,4,11,14H2,1-3H3,(H2,28,33)