N-[2-[3-(diethylamino)propylamino]-5-piperidin-1-ylsulfonyl-phenyl]-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: N-[2-[3-(diethylamino)propylamino]-5-piperidin-1-ylsulfonyl-phenyl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[2-[3-(diethylamino)propylamino]-5-(1-piperidylsulfonyl)phenyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[2-[3-(diethylamino)propylamino]-5-(1-piperidinylsulfonyl)phenyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[2-[3-(diethylamino)propylamino]-5-piperidin-1-ylsulfonylphenyl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[2-[3-(diethylamino)propylamino]-5-piperidinosulfonyl-phenyl]-2-keto-1H-quinoline-4-carboxamide Formula: C28H37N5O4S MolecularWeight: 539.68948

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC(=O)NC4=CC=CC=C43

Isomeric SMILES

CCN(CC)CCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C28H37N5O4S/c1-3-32(4-2)16-10-15-29-25-14-13-21(38(36,37)33-17-8-5-9-18-33)19-26(25)31-28(35)23-20-27(34)30-24-12-7-6-11-22(23)24/h6-7,11-14,19-20,29H,3-5,8-10,15-18H2,1-2H3,(H,30,34)(H,31,35)