5-[3-[1-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylsulfinamoyloxy]phenyl]sulfinamoyloxy-N1,N3-dicyclohexyl-benzene-1,3-dicarboxamide

Systemtic Name: 5-[3-[1-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylsulfinamoyloxy]phenyl]sulfinamoyloxy-N1,N3-dicyclohexyl-benzene-1,3-dicarboxamide Openeye Name: 5-[3-[1-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylsulfinamoyloxy]phenyl]sulfinamoyloxy-N1,N3-dicyclohexyl-benzene-1,3-dicarboxamide CAS Name: 5-[3-[1-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylsulfinamoyloxy]phenyl]sulfinamoyloxy-N1,N3-dicyclohexylbenzene-1,3-dicarboxamide IUPAC Name: 5-[3-[1-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylsulfinamoyloxy]phenyl]sulfinamoyloxy-1-N,3-N-dicyclohexylbenzene-1,3-dicarboxamide Traditional Name: 5-[3-[1-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylsulfinamoyloxy]phenyl]sulfinamoyloxy-N,N'-dicyclohexyl-isophthalamide Formula: C36H48N8O6S2 MolecularWeight: 752.94632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C2N1NC(=C2)C(C)(C)C)NS(=O)OC3=CC=CC(=C3)NS(=O)OC4=CC(=CC(=C4)C(=O)NC5CCCCC5)C(=O)NC6CCCCC6

Isomeric SMILES

CC(C1=NN=C2N1NC(=C2)C(C)(C)C)NS(=O)OC3=CC=CC(=C3)NS(=O)OC4=CC(=CC(=C4)C(=O)NC5CCCCC5)C(=O)NC6CCCCC6

InChI

InChI=1S/C36H48N8O6S2/c1-23(33-40-39-32-22-31(36(2,3)4)41-44(32)33)42-51(47)49-29-17-11-16-28(21-29)43-52(48)50-30-19-24(34(45)37-26-12-7-5-8-13-26)18-25(20-30)35(46)38-27-14-9-6-10-15-27/h11,16-23,26-27,41-43H,5-10,12-15H2,1-4H3,(H,37,45)(H,38,46)