N-[4-(3-morpholin-4-ylpropylamino)-3,4-bis(oxidanylidene)-1-phenyl-butan-2-yl]-1-naphthalen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(3-morpholin-4-ylpropylamino)-3,4-bis(oxidanylidene)-1-phenyl-butan-2-yl]-1-naphthalen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-benzyl-3-(3-morpholinopropylamino)-2,3-dioxo-propyl]-1-(2-naphthylsulfonyl)piperidine-4-carboxamide CAS Name: N-[4-[3-(4-morpholinyl)propylamino]-3,4-dioxo-1-phenylbutan-2-yl]-1-(2-naphthalenylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[4-(3-morpholin-4-ylpropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[1-benzyl-2,3-diketo-3-(3-morpholinopropylamino)propyl]-1-(2-naphthylsulfonyl)isonipecotamide Formula: C33H40N4O6S MolecularWeight: 620.7589

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(CC2=CC=CC=C2)C(=O)C(=O)NCCCN3CCOCC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC(CC2=CC=CC=C2)C(=O)C(=O)NCCCN3CCOCC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C33H40N4O6S/c38-31(33(40)34-15-6-16-36-19-21-43-22-20-36)30(23-25-7-2-1-3-8-25)35-32(39)27-13-17-37(18-14-27)44(41,42)29-12-11-26-9-4-5-10-28(26)24-29/h1-5,7-12,24,27,30H,6,13-23H2,(H,34,40)(H,35,39)