4-methoxy-N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 4-methoxy-N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-methoxy-N-[2-(3-methoxy-3-methyl-butyl)sulfanyl-1,3-benzothiazol-6-yl]-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-methoxy-N-[2-[(3-methoxy-3-methylbutyl)thio]-1,3-benzothiazol-6-yl]-1,3-dimethyl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 4-methoxy-N-[2-(3-methoxy-3-methylbutyl)sulfanyl-1,3-benzothiazol-6-yl]-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-methoxy-N-[2-[(3-methoxy-3-methyl-butyl)thio]-1,3-benzothiazol-6-yl]-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C23H27N5O3S2 MolecularWeight: 485.62218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)OC)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCCC(C)(C)OC)C

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)OC)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCCC(C)(C)OC)C

InChI

InChI=1S/C23H27N5O3S2/c1-13-18-19(30-5)15(12-24-20(18)28(4)27-13)21(29)25-14-7-8-16-17(11-14)33-22(26-16)32-10-9-23(2,3)31-6/h7-8,11-12H,9-10H2,1-6H3,(H,25,29)