N-[[(3R)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-3-yl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[(3R)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-3-yl]methyl]thiophene-2-carboxamide Openeye Name: N-[[(3R)-1-[(4-isopropylthiazol-2-yl)methyl]piperidin-1-ium-3-yl]methyl]thiophene-2-carboxamide CAS Name: N-[[(3R)-1-[(4-propan-2-yl-2-thiazolyl)methyl]-3-piperidin-1-iumyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[[(3R)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-3-yl]methyl]thiophene-2-carboxamide Traditional Name: N-[[(3R)-1-[(4-isopropylthiazol-2-yl)methyl]piperidin-1-ium-3-yl]methyl]thiophene-2-carboxamide Formula: C18H26N3OS2+ MolecularWeight: 364.54854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CSC(=N1)C[NH+]2CCCC(C2)CNC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C1=CSC(=N1)C[NH+]2CCC[C@@H](C2)CNC(=O)C3=CC=CS3

InChI

InChI=1S/C18H25N3OS2/c1-13(2)15-12-24-17(20-15)11-21-7-3-5-14(10-21)9-19-18(22)16-6-4-8-23-16/h4,6,8,12-14H,3,5,7,9-11H2,1-2H3,(H,19,22)/p+1/t14-/m1/s1