[1-methyl-2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propyl]amino]-6-oxidanylidene-4-pyridin-4-yl-pyrimidin-5-yl]carbamic acid

Systemtic Name: [1-methyl-2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propyl]amino]-6-oxidanylidene-4-pyridin-4-yl-pyrimidin-5-yl]carbamic acid Openeye Name: [2-[[2-(tert-butoxycarbonylamino)-3-phenyl-propyl]amino]-1-methyl-6-oxo-4-(4-pyridyl)pyrimidin-5-yl]carbamic acid CAS Name: [1-methyl-2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenylpropyl]amino]-6-oxo-4-pyridin-4-yl-5-pyrimidinyl]carbamic acid IUPAC Name: [1-methyl-2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropyl]amino]-6-oxo-4-pyridin-4-ylpyrimidin-5-yl]carbamic acid Traditional Name: [2-[[2-(tert-butoxycarbonylamino)-3-phenyl-propyl]amino]-6-keto-1-methyl-4-(4-pyridyl)pyrimidin-5-yl]carbamic acid Formula: C25H30N6O5 MolecularWeight: 494.5429

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CNC2=NC(=C(C(=O)N2C)NC(=O)O)C3=CC=NC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CNC2=NC(=C(C(=O)N2C)NC(=O)O)C3=CC=NC=C3

InChI

InChI=1S/C25H30N6O5/c1-25(2,3)36-24(35)28-18(14-16-8-6-5-7-9-16)15-27-22-29-19(17-10-12-26-13-11-17)20(30-23(33)34)21(32)31(22)4/h5-13,18,30H,14-15H2,1-4H3,(H,27,29)(H,28,35)(H,33,34)