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

Systemtic Name: 3-[1-(4-aminocarbonyl-2-methyl-phenyl)-5-(2-methoxypyrimidin-5-yl)pyrrol-2-yl]propanoic acid Openeye Name: 3-[1-(4-carbamoyl-2-methyl-phenyl)-5-(2-methoxypyrimidin-5-yl)pyrrol-2-yl]propanoic acid CAS Name: 3-[1-(4-carbamoyl-2-methylphenyl)-5-(2-methoxy-5-pyrimidinyl)-2-pyrrolyl]propanoic acid IUPAC Name: 3-[1-(4-carbamoyl-2-methylphenyl)-5-(2-methoxypyrimidin-5-yl)pyrrol-2-yl]propanoic acid Traditional Name: 3-[1-(4-carbamoyl-2-methyl-phenyl)-5-(2-methoxypyrimidin-5-yl)pyrrol-2-yl]propionic acid Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N)N2C(=CC=C2C3=CN=C(N=C3)OC)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N)N2C(=CC=C2C3=CN=C(N=C3)OC)CCC(=O)O

InChI

InChI=1S/C20H20N4O4/c1-12-9-13(19(21)27)3-6-16(12)24-15(5-8-18(25)26)4-7-17(24)14-10-22-20(28-2)23-11-14/h3-4,6-7,9-11H,5,8H2,1-2H3,(H2,21,27)(H,25,26)