1-(1,3-benzothiazol-2-yl)-4-(4-butoxyphenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-4-(4-butoxyphenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 1-(1,3-benzothiazol-2-yl)-4-(4-butoxyphenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 1-(1,3-benzothiazol-2-yl)-4-(4-butoxyphenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 1-(1,3-benzothiazol-2-yl)-4-(4-butoxyphenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 1-(1,3-benzothiazol-2-yl)-4-(4-butoxyphenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C24H24N4O2S MolecularWeight: 432.53796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2CC(=O)N=C3C2=C(NN3C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2CC(=O)N=C3C2=C(NN3C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C24H24N4O2S/c1-3-4-13-30-17-11-9-16(10-12-17)18-14-21(29)26-23-22(18)15(2)27-28(23)24-25-19-7-5-6-8-20(19)31-24/h5-12,18,27H,3-4,13-14H2,1-2H3