4-[2-[(1-azanyl-3-cyclohexyl-1-oxidanylidene-propan-2-yl)carbamoyl]-4-(pyridin-4-ylcarbonylamino)piperidin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-[(1-azanyl-3-cyclohexyl-1-oxidanylidene-propan-2-yl)carbamoyl]-4-(pyridin-4-ylcarbonylamino)piperidin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[[2-amino-1-(cyclohexylmethyl)-2-oxo-ethyl]carbamoyl]-4-(pyridine-4-carbonylamino)-1-piperidyl]-4-oxo-butanoic acid CAS Name: 4-[2-[[(1-amino-3-cyclohexyl-1-oxopropan-2-yl)amino]-oxomethyl]-4-[[oxo(pyridin-4-yl)methyl]amino]-1-piperidinyl]-4-oxobutanoic acid IUPAC Name: 4-[2-[(1-amino-3-cyclohexyl-1-oxopropan-2-yl)carbamoyl]-4-(pyridine-4-carbonylamino)piperidin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[2-[[2-amino-1-(cyclohexylmethyl)-2-keto-ethyl]carbamoyl]-4-isonicotinamido-piperidino]-4-keto-butyric acid Formula: C25H35N5O6 MolecularWeight: 501.5753

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)N)NC(=O)C2CC(CCN2C(=O)CCC(=O)O)NC(=O)C3=CC=NC=C3

Isomeric SMILES

C1CCC(CC1)CC(C(=O)N)NC(=O)C2CC(CCN2C(=O)CCC(=O)O)NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C25H35N5O6/c26-23(34)19(14-16-4-2-1-3-5-16)29-25(36)20-15-18(28-24(35)17-8-11-27-12-9-17)10-13-30(20)21(31)6-7-22(32)33/h8-9,11-12,16,18-20H,1-7,10,13-15H2,(H2,26,34)(H,28,35)(H,29,36)(H,32,33)