N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-(6-chlorothiochroman-4-yl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-1,3-dimethyl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-1,3-dimethylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-(6-chlorothiochroman-4-yl)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C18H17ClN4OS MolecularWeight: 372.87178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)C(=O)NC3CCSC4=C3C=C(C=C4)Cl)C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)C(=O)NC3CCSC4=C3C=C(C=C4)Cl)C

InChI

InChI=1S/C18H17ClN4OS/c1-10-13-7-11(9-20-17(13)23(2)22-10)18(24)21-15-5-6-25-16-4-3-12(19)8-14(15)16/h3-4,7-9,15H,5-6H2,1-2H3,(H,21,24)