1-(piperidin-1-ium-4-ylmethyl)-3-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]urea

Systemtic Name: 1-(piperidin-1-ium-4-ylmethyl)-3-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]urea Openeye Name: 1-(piperidin-1-ium-4-ylmethyl)-3-[4-(thiazol-2-ylsulfamoyl)phenyl]urea CAS Name: 1-(4-piperidin-1-iumylmethyl)-3-[4-(2-thiazolylsulfamoyl)phenyl]urea IUPAC Name: 1-(piperidin-1-ium-4-ylmethyl)-3-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]urea Traditional Name: 1-(piperidin-1-ium-4-ylmethyl)-3-[4-(thiazol-2-ylsulfamoyl)phenyl]urea Formula: C16H22N5O3S2+ MolecularWeight: 396.50758

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1CNC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

Isomeric SMILES

C1C[NH2+]CCC1CNC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

InChI

InChI=1S/C16H21N5O3S2/c22-15(19-11-12-5-7-17-8-6-12)20-13-1-3-14(4-2-13)26(23,24)21-16-18-9-10-25-16/h1-4,9-10,12,17H,5-8,11H2,(H,18,21)(H2,19,20,22)/p+1