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

Systemtic Name: (E)-3-[4-[[1-[[1-cyclopentyl-2-(furan-3-yl)benzimidazol-5-yl]carbonylamino]cyclopentyl]carbonylamino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[[1-[[1-cyclopentyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]cyclopentanecarbonyl]amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[[1-[[[1-cyclopentyl-2-(3-furanyl)-5-benzimidazolyl]-oxomethyl]amino]cyclopentyl]-oxomethyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[[1-[[1-cyclopentyl-2-(furan-3-yl)benzimidazole-5-carbonyl]amino]cyclopentanecarbonyl]amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[[1-[[1-cyclopentyl-2-(3-furyl)benzimidazole-5-carbonyl]amino]cyclopentanecarbonyl]amino]phenyl]acrylic acid Formula: C32H32N4O5 MolecularWeight: 552.62028

Click to see the large picture

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=COC=C6

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=COC=C6

InChI

InChI=1S/C32H32N4O5/c37-28(38)14-9-21-7-11-24(12-8-21)33-31(40)32(16-3-4-17-32)35-30(39)22-10-13-27-26(19-22)34-29(23-15-18-41-20-23)36(27)25-5-1-2-6-25/h7-15,18-20,25H,1-6,16-17H2,(H,33,40)(H,35,39)(H,37,38)/b14-9+