N-[1-tert-butyl-3-(3-oxidanylpiperidin-1-yl)carbonyl-pyrazolo[3,4-d][1,3]thiazol-5-yl]benzamide

Systemtic Name: N-[1-tert-butyl-3-(3-oxidanylpiperidin-1-yl)carbonyl-pyrazolo[3,4-d][1,3]thiazol-5-yl]benzamide Openeye Name: N-[1-tert-butyl-3-(3-hydroxypiperidine-1-carbonyl)pyrazolo[3,4-d]thiazol-5-yl]benzamide CAS Name: N-[1-tert-butyl-3-[(3-hydroxy-1-piperidinyl)-oxomethyl]-5-pyrazolo[3,4-d]thiazolyl]benzamide IUPAC Name: N-[1-tert-butyl-3-(3-hydroxypiperidine-1-carbonyl)pyrazolo[3,4-d][1,3]thiazol-5-yl]benzamide Traditional Name: N-[1-tert-butyl-3-(3-hydroxypiperidine-1-carbonyl)pyrazolo[3,4-d]thiazol-5-yl]benzamide Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C(=N1)C(=O)N3CCCC(C3)O)SC(=N2)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)N1C2=C(C(=N1)C(=O)N3CCCC(C3)O)SC(=N2)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H25N5O3S/c1-21(2,3)26-17-16(15(24-26)19(29)25-11-7-10-14(27)12-25)30-20(22-17)23-18(28)13-8-5-4-6-9-13/h4-6,8-9,14,27H,7,10-12H2,1-3H3,(H,22,23,28)