N-[4-(1,3-benzodioxol-5-yl)-3-[2-(5-methylsulfonylpyrimidin-2-yl)oxyethoxy]-1H-pyrazol-5-yl]-4-tert-butyl-benzenesulfonamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-3-[2-(5-methylsulfonylpyrimidin-2-yl)oxyethoxy]-1H-pyrazol-5-yl]-4-tert-butyl-benzenesulfonamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)-3-[2-(5-methylsulfonylpyrimidin-2-yl)oxyethoxy]-1H-pyrazol-5-yl]-4-tert-butyl-benzenesulfonamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-3-[2-[(5-methylsulfonyl-2-pyrimidinyl)oxy]ethoxy]-1H-pyrazol-5-yl]-4-tert-butylbenzenesulfonamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-3-[2-(5-methylsulfonylpyrimidin-2-yl)oxyethoxy]-1H-pyrazol-5-yl]-4-tert-butylbenzenesulfonamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)-3-[2-(5-mesylpyrimidin-2-yl)oxyethoxy]-1H-pyrazol-5-yl]-4-tert-butyl-benzenesulfonamide Formula: C27H29N5O8S2 MolecularWeight: 615.67786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NN2)OCCOC3=NC=C(C=N3)S(=O)(=O)C)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NN2)OCCOC3=NC=C(C=N3)S(=O)(=O)C)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H29N5O8S2/c1-27(2,3)18-6-8-19(9-7-18)42(35,36)32-24-23(17-5-10-21-22(13-17)40-16-39-21)25(31-30-24)37-11-12-38-26-28-14-20(15-29-26)41(4,33)34/h5-10,13-15H,11-12,16H2,1-4H3,(H2,30,31,32)