[2,6-di(propan-2-yl)phenyl] N-[4-(3-hydroxyphenyl)-1-pyrimidin-2-yl-piperidin-4-yl]carbonylsulfamate

Systemtic Name: [2,6-di(propan-2-yl)phenyl] N-[4-(3-hydroxyphenyl)-1-pyrimidin-2-yl-piperidin-4-yl]carbonylsulfamate Openeye Name: (2,6-diisopropylphenyl) N-[4-(3-hydroxyphenyl)-1-pyrimidin-2-yl-piperidine-4-carbonyl]sulfamate CAS Name: N-[[4-(3-hydroxyphenyl)-1-(2-pyrimidinyl)-4-piperidinyl]-oxomethyl]sulfamic acid [2,6-di(propan-2-yl)phenyl] ester IUPAC Name: [2,6-di(propan-2-yl)phenyl] N-[4-(3-hydroxyphenyl)-1-pyrimidin-2-ylpiperidine-4-carbonyl]sulfamate Traditional Name: N-[4-(3-hydroxyphenyl)-1-(2-pyrimidyl)isonipecotoyl]sulfamic acid (2,6-diisopropylphenyl) ester Formula: C28H34N4O5S MolecularWeight: 538.65836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)OS(=O)(=O)NC(=O)C2(CCN(CC2)C3=NC=CC=N3)C4=CC(=CC=C4)O

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)OS(=O)(=O)NC(=O)C2(CCN(CC2)C3=NC=CC=N3)C4=CC(=CC=C4)O

InChI

InChI=1S/C28H34N4O5S/c1-19(2)23-10-6-11-24(20(3)4)25(23)37-38(35,36)31-26(34)28(21-8-5-9-22(33)18-21)12-16-32(17-13-28)27-29-14-7-15-30-27/h5-11,14-15,18-20,33H,12-13,16-17H2,1-4H3,(H,31,34)