N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide

Systemtic Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide Openeye Name: N-[2-(diethylamino)-5-(1-piperidylsulfonyl)phenyl]-2-(4-oxocinnolin-1-yl)acetamide CAS Name: N-[2-(diethylamino)-5-(1-piperidinylsulfonyl)phenyl]-2-(4-oxo-1-cinnolinyl)acetamide IUPAC Name: N-[2-(diethylamino)-5-piperidin-1-ylsulfonylphenyl]-2-(4-oxocinnolin-1-yl)acetamide Traditional Name: N-[2-(diethylamino)-5-piperidinosulfonyl-phenyl]-2-(4-ketocinnolin-1-yl)acetamide Formula: C25H31N5O4S MolecularWeight: 497.60974

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C25H31N5O4S/c1-3-28(4-2)23-13-12-19(35(33,34)29-14-8-5-9-15-29)16-21(23)27-25(32)18-30-22-11-7-6-10-20(22)24(31)17-26-30/h6-7,10-13,16-17H,3-5,8-9,14-15,18H2,1-2H3,(H,27,32)