ethyl 6-hex-1-ynyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanyl-2-phenyl-pyrimidine-4-carboxylate

Systemtic Name: ethyl 6-hex-1-ynyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanyl-2-phenyl-pyrimidine-4-carboxylate Openeye Name: ethyl 1-(tert-butoxycarbonylamino)-6-hex-1-ynyl-6-hydroxy-2-phenyl-pyrimidine-4-carboxylate CAS Name: 6-hex-1-ynyl-6-hydroxy-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-phenyl-4-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-hex-1-ynyl-6-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylpyrimidine-4-carboxylate Traditional Name: 1-(tert-butoxycarbonylamino)-6-hex-1-ynyl-6-hydroxy-2-phenyl-pyrimidine-4-carboxylic acid ethyl ester Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1(C=C(N=C(N1NC(=O)OC(C)(C)C)C2=CC=CC=C2)C(=O)OCC)O

Isomeric SMILES

CCCCC#CC1(C=C(N=C(N1NC(=O)OC(C)(C)C)C2=CC=CC=C2)C(=O)OCC)O

InChI

InChI=1S/C24H31N3O5/c1-6-8-9-13-16-24(30)17-19(21(28)31-7-2)25-20(18-14-11-10-12-15-18)27(24)26-22(29)32-23(3,4)5/h10-12,14-15,17,30H,6-9H2,1-5H3,(H,26,29)