3-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)propylsulfinamoyloxy]-N-(2-hydroxyethyl)-4-methyl-benzamide

Systemtic Name: 3-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)propylsulfinamoyloxy]-N-(2-hydroxyethyl)-4-methyl-benzamide Openeye Name: 3-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)propylsulfinamoyloxy]-N-(2-hydroxyethyl)-4-methyl-benzamide CAS Name: 3-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)propylsulfinamoyloxy]-N-(2-hydroxyethyl)-4-methylbenzamide IUPAC Name: 3-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)propylsulfinamoyloxy]-N-(2-hydroxyethyl)-4-methylbenzamide Traditional Name: 3-[2-(6-tert-butyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)propylsulfinamoyloxy]-N-(2-hydroxyethyl)-4-methyl-benzamide Formula: C21H30N6O4S MolecularWeight: 462.5657

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCO)OS(=O)NCC(C)C2=NN=C3N2NC(=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCO)OS(=O)NCC(C)C2=NN=C3N2NC(=C3)C(C)(C)C

InChI

InChI=1S/C21H30N6O4S/c1-13-6-7-15(20(29)22-8-9-28)10-16(13)31-32(30)23-12-14(2)19-25-24-18-11-17(21(3,4)5)26-27(18)19/h6-7,10-11,14,23,26,28H,8-9,12H2,1-5H3,(H,22,29)