3-[1-(4-aminocarbonyl-2-methyl-phenyl)-5-[5-(2-methylimidazol-1-yl)thiophen-2-yl]pyrrol-2-yl]propanoic acid

Systemtic Name: 3-[1-(4-aminocarbonyl-2-methyl-phenyl)-5-[5-(2-methylimidazol-1-yl)thiophen-2-yl]pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(4-carbamoyl-2-methyl-phenyl)-5-[5-(2-methylimidazol-1-yl)-2-thienyl]pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(4-carbamoyl-2-methylphenyl)-5-[5-(2-methyl-1-imidazolyl)-2-thiophenyl]-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(4-carbamoyl-2-methylphenyl)-5-[5-(2-methylimidazol-1-yl)thiophen-2-yl]pyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(4-carbamoyl-2-methyl-phenyl)-5-[5-(2-methylimidazol-1-yl)-2-thienyl]pyrrol-2-yl]propionic acid Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N)N2C(=CC=C2C3=CC=C(S3)N4C=CN=C4C)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N)N2C(=CC=C2C3=CC=C(S3)N4C=CN=C4C)CCC(=O)O

InChI

InChI=1S/C23H22N4O3S/c1-14-13-16(23(24)30)3-6-18(14)27-17(5-10-22(28)29)4-7-19(27)20-8-9-21(31-20)26-12-11-25-15(26)2/h3-4,6-9,11-13H,5,10H2,1-2H3,(H2,24,30)(H,28,29)