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

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-4-(5-bromanyl-2-methoxy-phenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 1-(1,3-benzothiazol-2-yl)-4-(5-bromo-2-methoxy-phenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 1-(1,3-benzothiazol-2-yl)-4-(5-bromo-2-methoxyphenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 1-(1,3-benzothiazol-2-yl)-4-(5-bromo-2-methoxyphenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 1-(1,3-benzothiazol-2-yl)-4-(5-bromo-2-methoxy-phenyl)-3-methyl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C21H17BrN4O2S MolecularWeight: 469.35428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(CC(=O)N=C2N(N1)C3=NC4=CC=CC=C4S3)C5=C(C=CC(=C5)Br)OC

Isomeric SMILES

CC1=C2C(CC(=O)N=C2N(N1)C3=NC4=CC=CC=C4S3)C5=C(C=CC(=C5)Br)OC

InChI

InChI=1S/C21H17BrN4O2S/c1-11-19-14(13-9-12(22)7-8-16(13)28-2)10-18(27)24-20(19)26(25-11)21-23-15-5-3-4-6-17(15)29-21/h3-9,14,25H,10H2,1-2H3