2-[[2-[2-(dimethylamino)pyridin-4-yl]-3H-benzimidazol-5-yl]carbonylamino]-4-pyrrol-1-yl-butanoic acid

Systemtic Name: 2-[[2-[2-(dimethylamino)pyridin-4-yl]-3H-benzimidazol-5-yl]carbonylamino]-4-pyrrol-1-yl-butanoic acid Openeye Name: 2-[[2-[2-(dimethylamino)-4-pyridyl]-3H-benzimidazole-5-carbonyl]amino]-4-pyrrol-1-yl-butanoic acid CAS Name: 2-[[[2-[2-(dimethylamino)-4-pyridinyl]-3H-benzimidazol-5-yl]-oxomethyl]amino]-4-(1-pyrrolyl)butanoic acid IUPAC Name: 2-[[2-[2-(dimethylamino)pyridin-4-yl]-3H-benzimidazole-5-carbonyl]amino]-4-pyrrol-1-ylbutanoic acid Traditional Name: 2-[[2-[2-(dimethylamino)-4-pyridyl]-3H-benzimidazole-5-carbonyl]amino]-4-pyrrol-1-yl-butyric acid Formula: C23H24N6O3 MolecularWeight: 432.47506

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=CC(=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)NC(CCN4C=CC=C4)C(=O)O

Isomeric SMILES

CN(C)C1=NC=CC(=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)NC(CCN4C=CC=C4)C(=O)O

InChI

InChI=1S/C23H24N6O3/c1-28(2)20-14-15(7-9-24-20)21-25-17-6-5-16(13-19(17)26-21)22(30)27-18(23(31)32)8-12-29-10-3-4-11-29/h3-7,9-11,13-14,18H,8,12H2,1-2H3,(H,25,26)(H,27,30)(H,31,32)