[(2R)-3-(4-butoxycarbonylpiperazin-1-yl)-2-[(6-methyl-2-phenyl-pyrimidin-4-yl)carbonylamino]-3-oxidanylidene-propyl]phosphonic acid

Systemtic Name: [(2R)-3-(4-butoxycarbonylpiperazin-1-yl)-2-[(6-methyl-2-phenyl-pyrimidin-4-yl)carbonylamino]-3-oxidanylidene-propyl]phosphonic acid Openeye Name: [(2R)-3-(4-butoxycarbonylpiperazin-1-yl)-2-[(6-methyl-2-phenyl-pyrimidine-4-carbonyl)amino]-3-oxo-propyl]phosphonic acid CAS Name: [(2R)-3-[4-[butoxy(oxo)methyl]-1-piperazinyl]-2-[[(6-methyl-2-phenyl-4-pyrimidinyl)-oxomethyl]amino]-3-oxopropyl]phosphonic acid IUPAC Name: [(2R)-3-(4-butoxycarbonylpiperazin-1-yl)-2-[(6-methyl-2-phenylpyrimidine-4-carbonyl)amino]-3-oxopropyl]phosphonic acid Traditional Name: [(2R)-3-(4-butoxycarbonylpiperazino)-3-keto-2-[(6-methyl-2-phenyl-pyrimidine-4-carbonyl)amino]propyl]phosphonic acid Formula: C24H32N5O7P MolecularWeight: 533.513941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1CCN(CC1)C(=O)C(CP(=O)(O)O)NC(=O)C2=CC(=NC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CP(=O)(O)O)NC(=O)C2=CC(=NC(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C24H32N5O7P/c1-3-4-14-36-24(32)29-12-10-28(11-13-29)23(31)20(16-37(33,34)35)27-22(30)19-15-17(2)25-21(26-19)18-8-6-5-7-9-18/h5-9,15,20H,3-4,10-14,16H2,1-2H3,(H,27,30)(H2,33,34,35)/t20-/m0/s1