1-(3-azanyl-7-methoxy-pyrazolo[3,4-b]quinolin-1-yl)-3-(phenylsulfonyl)propan-1-one

Systemtic Name: 1-(3-azanyl-7-methoxy-pyrazolo[3,4-b]quinolin-1-yl)-3-(phenylsulfonyl)propan-1-one Openeye Name: 1-(3-amino-7-methoxy-pyrazolo[3,4-b]quinolin-1-yl)-3-(benzenesulfonyl)propan-1-one CAS Name: 1-(3-amino-7-methoxy-1-pyrazolo[3,4-b]quinolinyl)-3-(benzenesulfonyl)-1-propanone IUPAC Name: 1-(3-amino-7-methoxypyrazolo[3,4-b]quinolin-1-yl)-3-(benzenesulfonyl)propan-1-one Traditional Name: 1-(3-amino-7-methoxy-pyrazolo[3,4-b]quinolin-1-yl)-3-besyl-propan-1-one Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC3=C(C=C2C=C1)C(=NN3C(=O)CCS(=O)(=O)C4=CC=CC=C4)N

Isomeric SMILES

COC1=CC2=NC3=C(C=C2C=C1)C(=NN3C(=O)CCS(=O)(=O)C4=CC=CC=C4)N

InChI

InChI=1S/C20H18N4O4S/c1-28-14-8-7-13-11-16-19(21)23-24(20(16)22-17(13)12-14)18(25)9-10-29(26,27)15-5-3-2-4-6-15/h2-8,11-12H,9-10H2,1H3,(H2,21,23)