tert-butyl N-[5-[(E)-hydroxyiminomethyl]-4-[(4-iodophenyl)amino]-6-phenylmethoxy-pyrimidin-2-yl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[5-[(E)-hydroxyiminomethyl]-4-[(4-iodophenyl)amino]-6-phenylmethoxy-pyrimidin-2-yl]-N-methyl-carbamate Openeye Name: tert-butyl N-[4-benzyloxy-5-[(E)-hydroxyiminomethyl]-6-(4-iodoanilino)pyrimidin-2-yl]-N-methyl-carbamate CAS Name: N-[5-[(E)-hydroxyiminomethyl]-4-(4-iodoanilino)-6-phenylmethoxy-2-pyrimidinyl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[(E)-hydroxyiminomethyl]-4-(4-iodoanilino)-6-phenylmethoxypyrimidin-2-yl]-N-methylcarbamate Traditional Name: N-[4-benzoxy-5-[(E)-hydroximinomethyl]-6-(4-iodoanilino)pyrimidin-2-yl]-N-methyl-carbamic acid tert-butyl ester Formula: C24H26IN5O4 MolecularWeight: 575.39881

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)C1=NC(=C(C(=N1)OCC2=CC=CC=C2)C=NO)NC3=CC=C(C=C3)I

Isomeric SMILES

CC(C)(C)OC(=O)N(C)C1=NC(=C(C(=N1)OCC2=CC=CC=C2)/C=N/O)NC3=CC=C(C=C3)I

InChI

InChI=1S/C24H26IN5O4/c1-24(2,3)34-23(31)30(4)22-28-20(27-18-12-10-17(25)11-13-18)19(14-26-32)21(29-22)33-15-16-8-6-5-7-9-16/h5-14,32H,15H2,1-4H3,(H,27,28,29)/b26-14+