2-chloranyl-N-[2-oxidanylidene-2-[[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]amino]ethyl]benzamide

Systemtic Name: 2-chloranyl-N-[2-oxidanylidene-2-[[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]amino]ethyl]benzamide Openeye Name: 2-chloro-N-[2-oxo-2-[[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]amino]ethyl]benzamide CAS Name: 2-chloro-N-[2-oxo-2-[[4-(1-piperidin-1-iumylmethyl)-2-thiazolyl]amino]ethyl]benzamide IUPAC Name: 2-chloro-N-[2-oxo-2-[[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]amino]ethyl]benzamide Traditional Name: 2-chloro-N-[2-keto-2-[[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]amino]ethyl]benzamide Formula: C18H22ClN4O2S+ MolecularWeight: 393.91088

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)CNC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)CNC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H21ClN4O2S/c19-15-7-3-2-6-14(15)17(25)20-10-16(24)22-18-21-13(12-26-18)11-23-8-4-1-5-9-23/h2-3,6-7,12H,1,4-5,8-11H2,(H,20,25)(H,21,22,24)/p+1