2-[(phenylmethyl)carbamoylamino]-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]ethanamide

Systemtic Name: 2-[(phenylmethyl)carbamoylamino]-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]ethanamide Openeye Name: 2-(benzylcarbamoylamino)-N-[[2-(1-piperidylsulfonyl)phenyl]methyl]acetamide CAS Name: 2-[[oxo-[(phenylmethyl)amino]methyl]amino]-N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]acetamide IUPAC Name: 2-(benzylcarbamoylamino)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]acetamide Traditional Name: 2-(benzylcarbamoylamino)-N-(2-piperidinosulfonylbenzyl)acetamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)CNC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)CNC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O4S/c27-21(17-25-22(28)24-15-18-9-3-1-4-10-18)23-16-19-11-5-6-12-20(19)31(29,30)26-13-7-2-8-14-26/h1,3-6,9-12H,2,7-8,13-17H2,(H,23,27)(H2,24,25,28)