1-[1-[(2-methylsulfanyl-1,3-thiazol-4-yl)carbonyl]piperidin-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-[(2-methylsulfanyl-1,3-thiazol-4-yl)carbonyl]piperidin-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide Openeye Name: N-isopropyl-1-[1-(2-methylsulfanylthiazole-4-carbonyl)-4-piperidyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[[2-(methylthio)-4-thiazolyl]-oxomethyl]-4-piperidinyl]-N-propan-2-yl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-(2-methylsulfanyl-1,3-thiazole-4-carbonyl)piperidin-4-yl]-N-propan-2-ylpiperidin-1-ium-4-carboxamide Traditional Name: N-isopropyl-1-[1-[2-(methylthio)thiazole-4-carbonyl]-4-piperidyl]piperidin-1-ium-4-carboxamide Formula: C19H31N4O2S2+ MolecularWeight: 411.60504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC[NH+](CC1)C2CCN(CC2)C(=O)C3=CSC(=N3)SC

Isomeric SMILES

CC(C)NC(=O)C1CC[NH+](CC1)C2CCN(CC2)C(=O)C3=CSC(=N3)SC

InChI

InChI=1S/C19H30N4O2S2/c1-13(2)20-17(24)14-4-8-22(9-5-14)15-6-10-23(11-7-15)18(25)16-12-27-19(21-16)26-3/h12-15H,4-11H2,1-3H3,(H,20,24)/p+1