3-iodanyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: 3-iodanyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]benzamide Openeye Name: 3-iodo-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]benzamide CAS Name: 3-iodo-N-[4-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-thiazolyl]benzamide IUPAC Name: 3-iodo-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1,3-thiazol-2-yl]benzamide Traditional Name: 3-iodo-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]thiazol-2-yl]benzamide Formula: C17H21IN3OS+ MolecularWeight: 442.33761

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)C3=CC(=CC=C3)I

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CSC(=N2)NC(=O)C3=CC(=CC=C3)I

InChI

InChI=1S/C17H20IN3OS/c1-12-5-7-21(8-6-12)10-15-11-23-17(19-15)20-16(22)13-3-2-4-14(18)9-13/h2-4,9,11-12H,5-8,10H2,1H3,(H,19,20,22)/p+1