N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-3-(phenylsulfonylmethyl)furan-2-carboxamide

Systemtic Name: N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-3-(phenylsulfonylmethyl)furan-2-carboxamide Openeye Name: 3-(benzenesulfonylmethyl)-N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)furan-2-carboxamide CAS Name: 3-(benzenesulfonylmethyl)-N-(1,3-dimethyl-5-pyrazolo[3,4-b]pyridinyl)-2-furancarboxamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)furan-2-carboxamide Traditional Name: 3-(besylmethyl)-N-(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)-2-furamide Formula: C20H18N4O4S MolecularWeight: 410.44632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C=C12)NC(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C2=NC=C(C=C12)NC(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C20H18N4O4S/c1-13-17-10-15(11-21-19(17)24(2)23-13)22-20(25)18-14(8-9-28-18)12-29(26,27)16-6-4-3-5-7-16/h3-11H,12H2,1-2H3,(H,22,25)