N-carbamimidoyl-2-(naphthalen-2-ylsulfonylamino)-N-(1-oxidanylidene-3-phenyl-1-piperidin-1-yl-propan-2-yl)ethanamide

Systemtic Name: N-carbamimidoyl-2-(naphthalen-2-ylsulfonylamino)-N-(1-oxidanylidene-3-phenyl-1-piperidin-1-yl-propan-2-yl)ethanamide Openeye Name: N-[1-benzyl-2-oxo-2-(1-piperidyl)ethyl]-N-carbamimidoyl-2-(2-naphthylsulfonylamino)acetamide CAS Name: N-carbamimidoyl-2-(2-naphthalenylsulfonylamino)-N-[1-oxo-3-phenyl-1-(1-piperidinyl)propan-2-yl]acetamide IUPAC Name: N-carbamimidoyl-2-(naphthalen-2-ylsulfonylamino)-N-(1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl)acetamide Traditional Name: N-amidino-N-(1-benzyl-2-keto-2-piperidino-ethyl)-2-(2-naphthylsulfonylamino)acetamide Formula: C27H31N5O4S MolecularWeight: 521.63114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(CC2=CC=CC=C2)N(C(=O)CNS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(=N)N

Isomeric SMILES

C1CCN(CC1)C(=O)C(CC2=CC=CC=C2)N(C(=O)CNS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C(=N)N

InChI

InChI=1S/C27H31N5O4S/c28-27(29)32(24(17-20-9-3-1-4-10-20)26(34)31-15-7-2-8-16-31)25(33)19-30-37(35,36)23-14-13-21-11-5-6-12-22(21)18-23/h1,3-6,9-14,18,24,30H,2,7-8,15-17,19H2,(H3,28,29)