2-azanyl-1-(5-oxidanylpentyl)-3-(phenylsulfonyl)-6H-pyrrolo[2,3-d]pyridazin-7-one

Systemtic Name: 2-azanyl-1-(5-oxidanylpentyl)-3-(phenylsulfonyl)-6H-pyrrolo[2,3-d]pyridazin-7-one Openeye Name: 2-amino-3-(benzenesulfonyl)-1-(5-hydroxypentyl)-6H-pyrrolo[2,3-d]pyridazin-7-one CAS Name: 2-amino-3-(benzenesulfonyl)-1-(5-hydroxypentyl)-6H-pyrrolo[2,3-d]pyridazin-7-one IUPAC Name: 2-amino-3-(benzenesulfonyl)-1-(5-hydroxypentyl)-6H-pyrrolo[2,3-d]pyridazin-7-one Traditional Name: 2-amino-3-besyl-1-(5-hydroxypentyl)-6H-pyrrolo[2,3-d]pyridazin-7-one Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=C2C=NNC3=O)CCCCCO)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=C2C=NNC3=O)CCCCCO)N

InChI

InChI=1S/C17H20N4O4S/c18-16-15(26(24,25)12-7-3-1-4-8-12)13-11-19-20-17(23)14(13)21(16)9-5-2-6-10-22/h1,3-4,7-8,11,22H,2,5-6,9-10,18H2,(H,20,23)