2-[2-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)-2-methyl-propyl]sulfinamoyloxy-4-octyl-phenoxy]-N,N-bis(2-hydroxyethyl)propanamide

Systemtic Name: 2-[2-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)-2-methyl-propyl]sulfinamoyloxy-4-octyl-phenoxy]-N,N-bis(2-hydroxyethyl)propanamide Openeye Name: 2-[2-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)-2-methyl-propyl]sulfinamoyloxy-4-octyl-phenoxy]-N,N-bis(2-hydroxyethyl)propanamide CAS Name: 2-[2-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)-2-methylpropyl]sulfinamoyloxy-4-octylphenoxy]-N,N-bis(2-hydroxyethyl)propanamide IUPAC Name: 2-[2-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)-2-methylpropyl]sulfinamoyloxy-4-octylphenoxy]-N,N-bis(2-hydroxyethyl)propanamide Traditional Name: 2-[2-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)-2-methyl-propyl]sulfinamoyloxy-4-octyl-phenoxy]-N,N-bis(2-hydroxyethyl)propionamide Formula: C33H54N6O6S MolecularWeight: 662.88346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)OC(C)C(=O)N(CCO)CCO)OS(=O)NCC(C)(C)C2=NN=C3N2NC(=C3)C(C)(C)C

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)OC(C)C(=O)N(CCO)CCO)OS(=O)NCC(C)(C)C2=NN=C3N2NC(=C3)C(C)(C)C

InChI

InChI=1S/C33H54N6O6S/c1-8-9-10-11-12-13-14-25-15-16-26(44-24(2)30(42)38(17-19-40)18-20-41)27(21-25)45-46(43)34-23-33(6,7)31-36-35-29-22-28(32(3,4)5)37-39(29)31/h15-16,21-22,24,34,37,40-41H,8-14,17-20,23H2,1-7H3