3-[[1-[3-[(5-methylfuran-2-yl)methylcarbamoylamino]phenyl]-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-3-pyridin-3-yl-propanoic acid

Systemtic Name: 3-[[1-[3-[(5-methylfuran-2-yl)methylcarbamoylamino]phenyl]-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]-3-pyridin-3-yl-propanoic acid Openeye Name: 3-[[1-[3-[(5-methyl-2-furyl)methylcarbamoylamino]phenyl]-5-oxo-pyrrolidine-3-carbonyl]amino]-3-(3-pyridyl)propanoic acid CAS Name: 3-[[[1-[3-[[[(5-methyl-2-furanyl)methylamino]-oxomethyl]amino]phenyl]-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]-3-(3-pyridinyl)propanoic acid IUPAC Name: 3-[[1-[3-[(5-methylfuran-2-yl)methylcarbamoylamino]phenyl]-5-oxopyrrolidine-3-carbonyl]amino]-3-pyridin-3-ylpropanoic acid Traditional Name: 3-[[5-keto-1-[3-[(5-methyl-2-furyl)methylcarbamoylamino]phenyl]pyrrolidine-3-carbonyl]amino]-3-(3-pyridyl)propionic acid Formula: C26H27N5O6 MolecularWeight: 505.52248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC(=O)NC2=CC=CC(=C2)N3CC(CC3=O)C(=O)NC(CC(=O)O)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(O1)CNC(=O)NC2=CC=CC(=C2)N3CC(CC3=O)C(=O)NC(CC(=O)O)C4=CN=CC=C4

InChI

InChI=1S/C26H27N5O6/c1-16-7-8-21(37-16)14-28-26(36)29-19-5-2-6-20(11-19)31-15-18(10-23(31)32)25(35)30-22(12-24(33)34)17-4-3-9-27-13-17/h2-9,11,13,18,22H,10,12,14-15H2,1H3,(H,30,35)(H,33,34)(H2,28,29,36)