(E)-3-[4-[[1-[(1-cyclopentyl-2-pyridin-2-yl-benzimidazol-5-yl)carbonylamino]cyclopentyl]carbonylamino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[[1-[(1-cyclopentyl-2-pyridin-2-yl-benzimidazol-5-yl)carbonylamino]cyclopentyl]carbonylamino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[[1-[[1-cyclopentyl-2-(2-pyridyl)benzimidazole-5-carbonyl]amino]cyclopentanecarbonyl]amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[[1-[[[1-cyclopentyl-2-(2-pyridinyl)-5-benzimidazolyl]-oxomethyl]amino]cyclopentyl]-oxomethyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[[1-[(1-cyclopentyl-2-pyridin-2-ylbenzimidazole-5-carbonyl)amino]cyclopentanecarbonyl]amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[[1-[[1-cyclopentyl-2-(2-pyridyl)benzimidazole-5-carbonyl]amino]cyclopentanecarbonyl]amino]phenyl]acrylic acid Formula: C33H33N5O4 MolecularWeight: 563.64622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)NC4(CCCC4)C(=O)NC5=CC=C(C=C5)C=CC(=O)O)N=C2C6=CC=CC=N6

Isomeric SMILES

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)NC4(CCCC4)C(=O)NC5=CC=C(C=C5)/C=C/C(=O)O)N=C2C6=CC=CC=N6

InChI

InChI=1S/C33H33N5O4/c39-29(40)17-12-22-10-14-24(15-11-22)35-32(42)33(18-4-5-19-33)37-31(41)23-13-16-28-27(21-23)36-30(26-9-3-6-20-34-26)38(28)25-7-1-2-8-25/h3,6,9-17,20-21,25H,1-2,4-5,7-8,18-19H2,(H,35,42)(H,37,41)(H,39,40)/b17-12+