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

Systemtic Name: N-[[4-(4-methylpiperazin-1-yl)-1-[3-(naphthalen-2-ylsulfonylamino)-3-phenyl-propanoyl]piperidin-4-yl]methyl]-2-phenyl-ethanamide Openeye Name: N-[[4-(4-methylpiperazin-1-yl)-1-[3-(2-naphthylsulfonylamino)-3-phenyl-propanoyl]-4-piperidyl]methyl]-2-phenyl-acetamide CAS Name: N-[[4-(4-methyl-1-piperazinyl)-1-[3-(2-naphthalenylsulfonylamino)-1-oxo-3-phenylpropyl]-4-piperidinyl]methyl]-2-phenylacetamide IUPAC Name: N-[[4-(4-methylpiperazin-1-yl)-1-[3-(naphthalen-2-ylsulfonylamino)-3-phenylpropanoyl]piperidin-4-yl]methyl]-2-phenylacetamide Traditional Name: N-[[4-(4-methylpiperazino)-1-[3-(2-naphthylsulfonylamino)-3-phenyl-propanoyl]-4-piperidyl]methyl]-2-phenyl-acetamide Formula: C38H45N5O4S MolecularWeight: 667.86

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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)CC6=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)CC6=CC=CC=C6

InChI

InChI=1S/C38H45N5O4S/c1-41-22-24-43(25-23-41)38(29-39-36(44)26-30-10-4-2-5-11-30)18-20-42(21-19-38)37(45)28-35(32-13-6-3-7-14-32)40-48(46,47)34-17-16-31-12-8-9-15-33(31)27-34/h2-17,27,35,40H,18-26,28-29H2,1H3,(H,39,44)