N-[[4-(4-methylpiperazin-1-yl)-1-[3-(naphthalen-2-ylsulfonylamino)-3-phenyl-propanoyl]piperidin-4-yl]methyl]benzamide

Systemtic Name: N-[[4-(4-methylpiperazin-1-yl)-1-[3-(naphthalen-2-ylsulfonylamino)-3-phenyl-propanoyl]piperidin-4-yl]methyl]benzamide Openeye Name: N-[[4-(4-methylpiperazin-1-yl)-1-[3-(2-naphthylsulfonylamino)-3-phenyl-propanoyl]-4-piperidyl]methyl]benzamide CAS Name: N-[[4-(4-methyl-1-piperazinyl)-1-[3-(2-naphthalenylsulfonylamino)-1-oxo-3-phenylpropyl]-4-piperidinyl]methyl]benzamide IUPAC Name: N-[[4-(4-methylpiperazin-1-yl)-1-[3-(naphthalen-2-ylsulfonylamino)-3-phenylpropanoyl]piperidin-4-yl]methyl]benzamide Traditional Name: N-[[4-(4-methylpiperazino)-1-[3-(2-naphthylsulfonylamino)-3-phenyl-propanoyl]-4-piperidyl]methyl]benzamide Formula: C37H43N5O4S MolecularWeight: 653.83342

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2(CCN(CC2)C(=O)CC(C3=CC=CC=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4)CNC(=O)C6=CC=CC=C6

Isomeric SMILES

CN1CCN(CC1)C2(CCN(CC2)C(=O)CC(C3=CC=CC=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4)CNC(=O)C6=CC=CC=C6

InChI

InChI=1S/C37H43N5O4S/c1-40-22-24-42(25-23-40)37(28-38-36(44)31-13-6-3-7-14-31)18-20-41(21-19-37)35(43)27-34(30-11-4-2-5-12-30)39-47(45,46)33-17-16-29-10-8-9-15-32(29)26-33/h2-17,26,34,39H,18-25,27-28H2,1H3,(H,38,44)