4-tert-butyl-N-[2-(4-methanoylpiperazin-1-yl)-5-(2-methoxyphenoxy)-4-oxidanylidene-1H-pyrimidin-6-yl]-N-(1-phenylethyl)benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[2-(4-methanoylpiperazin-1-yl)-5-(2-methoxyphenoxy)-4-oxidanylidene-1H-pyrimidin-6-yl]-N-(1-phenylethyl)benzenesulfonamide Openeye Name: 4-tert-butyl-N-[2-(4-formylpiperazin-1-yl)-5-(2-methoxyphenoxy)-4-oxo-1H-pyrimidin-6-yl]-N-(1-phenylethyl)benzenesulfonamide CAS Name: 4-tert-butyl-N-[2-(4-formyl-1-piperazinyl)-5-(2-methoxyphenoxy)-4-oxo-1H-pyrimidin-6-yl]-N-(1-phenylethyl)benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[2-(4-formylpiperazin-1-yl)-5-(2-methoxyphenoxy)-4-oxo-1H-pyrimidin-6-yl]-N-(1-phenylethyl)benzenesulfonamide Traditional Name: 4-tert-butyl-N-[2-(4-formylpiperazino)-4-keto-5-(2-methoxyphenoxy)-1H-pyrimidin-6-yl]-N-(1-phenylethyl)benzenesulfonamide Formula: C34H39N5O6S MolecularWeight: 645.76836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C2=C(C(=O)N=C(N2)N3CCN(CC3)C=O)OC4=CC=CC=C4OC)S(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC(C1=CC=CC=C1)N(C2=C(C(=O)N=C(N2)N3CCN(CC3)C=O)OC4=CC=CC=C4OC)S(=O)(=O)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C34H39N5O6S/c1-24(25-11-7-6-8-12-25)39(46(42,43)27-17-15-26(16-18-27)34(2,3)4)31-30(45-29-14-10-9-13-28(29)44-5)32(41)36-33(35-31)38-21-19-37(23-40)20-22-38/h6-18,23-24H,19-22H2,1-5H3,(H,35,36,41)