1-cyano-2-[6-[2-morpholin-4-ylethoxy-(phenylmethyl)sulfamoyl]hexyl]-3-pyridin-4-yl-guanidine

Systemtic Name: 1-cyano-2-[6-[2-morpholin-4-ylethoxy-(phenylmethyl)sulfamoyl]hexyl]-3-pyridin-4-yl-guanidine Openeye Name: 2-[6-[benzyl(2-morpholinoethoxy)sulfamoyl]hexyl]-1-cyano-3-(4-pyridyl)guanidine CAS Name: 1-cyano-2-[6-[2-(4-morpholinyl)ethoxy-(phenylmethyl)sulfamoyl]hexyl]-3-pyridin-4-ylguanidine IUPAC Name: 2-[6-[benzyl(2-morpholin-4-ylethoxy)sulfamoyl]hexyl]-1-cyano-3-pyridin-4-ylguanidine Traditional Name: 2-[6-[benzyl(2-morpholinoethoxy)sulfamoyl]hexyl]-1-cyano-3-(4-pyridyl)guanidine Formula: C26H37N7O4S MolecularWeight: 543.68148

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCON(CC2=CC=CC=C2)S(=O)(=O)CCCCCCN=C(NC#N)NC3=CC=NC=C3

Isomeric SMILES

C1COCCN1CCON(CC2=CC=CC=C2)S(=O)(=O)CCCCCCN=C(NC#N)NC3=CC=NC=C3

InChI

InChI=1S/C26H37N7O4S/c27-23-30-26(31-25-10-13-28-14-11-25)29-12-6-1-2-7-21-38(34,35)33(22-24-8-4-3-5-9-24)37-20-17-32-15-18-36-19-16-32/h3-5,8-11,13-14H,1-2,6-7,12,15-22H2,(H2,28,29,30,31)