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

Systemtic Name: 4-methoxy-1,3-dimethyl-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-methoxy-1,3-dimethyl-N-[2-[2-(3-thienyl)ethylsulfanyl]-1,3-benzothiazol-6-yl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-methoxy-1,3-dimethyl-N-[2-[2-(3-thiophenyl)ethylthio]-1,3-benzothiazol-6-yl]-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 4-methoxy-1,3-dimethyl-N-[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-methoxy-1,3-dimethyl-N-[2-[2-(3-thienyl)ethylthio]-1,3-benzothiazol-6-yl]pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C23H21N5O2S3 MolecularWeight: 495.64014

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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)SCCC5=CSC=C5)C

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)OC)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCCC5=CSC=C5)C

InChI

InChI=1S/C23H21N5O2S3/c1-13-19-20(30-3)16(11-24-21(19)28(2)27-13)22(29)25-15-4-5-17-18(10-15)33-23(26-17)32-9-7-14-6-8-31-12-14/h4-6,8,10-12H,7,9H2,1-3H3,(H,25,29)