N-[N-[2-oxidanylidene-4-[(phenylmethyl)sulfonylamino]-1H-pyridin-3-yl]-N'-piperidin-3-yl-carbamimidoyl]ethanamide

Systemtic Name: N-[N-[2-oxidanylidene-4-[(phenylmethyl)sulfonylamino]-1H-pyridin-3-yl]-N'-piperidin-3-yl-carbamimidoyl]ethanamide Openeye Name: N-[N-[4-(benzylsulfonylamino)-2-oxo-1H-pyridin-3-yl]-N'-(3-piperidyl)carbamimidoyl]acetamide CAS Name: N-[[[2-oxo-4-[(phenylmethyl)sulfonylamino]-1H-pyridin-3-yl]amino]-(3-piperidinylimino)methyl]acetamide IUPAC Name: N-[N-[4-(benzylsulfonylamino)-2-oxo-1H-pyridin-3-yl]-N'-piperidin-3-ylcarbamimidoyl]acetamide Traditional Name: N-[N-[4-(benzylsulfonylamino)-2-keto-1H-pyridin-3-yl]-N'-(3-piperidyl)amidino]acetamide Formula: C20H26N6O4S MolecularWeight: 446.52324

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=NC1CCCNC1)NC2=C(C=CNC2=O)NS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC(=NC1CCCNC1)NC2=C(C=CNC2=O)NS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N6O4S/c1-14(27)23-20(24-16-8-5-10-21-12-16)25-18-17(9-11-22-19(18)28)26-31(29,30)13-15-6-3-2-4-7-15/h2-4,6-7,9,11,16,21H,5,8,10,12-13H2,1H3,(H2,22,26,28)(H2,23,24,25,27)