N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-6-[[(3R)-1-methylpiperidin-1-ium-3-yl]methylamino]pyridine-3-carboxamide

Systemtic Name: N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-6-[[(3R)-1-methylpiperidin-1-ium-3-yl]methylamino]pyridine-3-carboxamide Openeye Name: N-[(4-ethylthiazol-2-yl)methyl]-6-[[(3R)-1-methylpiperidin-1-ium-3-yl]methylamino]pyridine-3-carboxamide CAS Name: N-[(4-ethyl-2-thiazolyl)methyl]-6-[[(3R)-1-methyl-3-piperidin-1-iumyl]methylamino]-3-pyridinecarboxamide IUPAC Name: N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-6-[[(3R)-1-methylpiperidin-1-ium-3-yl]methylamino]pyridine-3-carboxamide Traditional Name: N-[(4-ethylthiazol-2-yl)methyl]-6-[[(3R)-1-methylpiperidin-1-ium-3-yl]methylamino]nicotinamide Formula: C19H28N5OS+ MolecularWeight: 374.52352

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CSC(=N1)CNC(=O)C2=CN=C(C=C2)NCC3CCC[NH+](C3)C

Isomeric SMILES

CCC1=CSC(=N1)CNC(=O)C2=CN=C(C=C2)NC[C@H]3CCC[NH+](C3)C

InChI

InChI=1S/C19H27N5OS/c1-3-16-13-26-18(23-16)11-22-19(25)15-6-7-17(21-10-15)20-9-14-5-4-8-24(2)12-14/h6-7,10,13-14H,3-5,8-9,11-12H2,1-2H3,(H,20,21)(H,22,25)/p+1/t14-/m1/s1