3-[5-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonylamino]benzimidazol-1-yl]-3-phenyl-propanoic acid

Systemtic Name: 3-[5-[(5-methyl-2-phenyl-1,2,3-triazol-4-yl)carbonylamino]benzimidazol-1-yl]-3-phenyl-propanoic acid Openeye Name: 3-[5-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]benzimidazol-1-yl]-3-phenyl-propanoic acid CAS Name: 3-[5-[[(5-methyl-2-phenyl-4-triazolyl)-oxomethyl]amino]-1-benzimidazolyl]-3-phenylpropanoic acid IUPAC Name: 3-[5-[(5-methyl-2-phenyltriazole-4-carbonyl)amino]benzimidazol-1-yl]-3-phenylpropanoic acid Traditional Name: 3-[5-[(5-methyl-2-phenyl-triazole-4-carbonyl)amino]benzimidazol-1-yl]-3-phenyl-propionic acid Formula: C26H22N6O3 MolecularWeight: 466.49128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2=CC3=C(C=C2)N(C=N3)C(CC(=O)O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(N=C1C(=O)NC2=CC3=C(C=C2)N(C=N3)C(CC(=O)O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H22N6O3/c1-17-25(30-32(29-17)20-10-6-3-7-11-20)26(35)28-19-12-13-22-21(14-19)27-16-31(22)23(15-24(33)34)18-8-4-2-5-9-18/h2-14,16,23H,15H2,1H3,(H,28,35)(H,33,34)