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

Systemtic Name: 4-methoxy-1,3-dimethyl-N-[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-[2-(2-isopropylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]-4-methoxy-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-methoxy-1,3-dimethyl-N-[2-[2-(propan-2-ylthio)ethylthio]-1,3-benzothiazol-6-yl]-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 4-methoxy-1,3-dimethyl-N-[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-[2-[2-(isopropylthio)ethylthio]-1,3-benzothiazol-6-yl]-4-methoxy-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C22H25N5O2S3 MolecularWeight: 487.6612

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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)SCCSC(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H25N5O2S3/c1-12(2)30-8-9-31-22-25-16-7-6-14(10-17(16)32-22)24-21(28)15-11-23-20-18(19(15)29-5)13(3)26-27(20)4/h6-7,10-12H,8-9H2,1-5H3,(H,24,28)