N-[(2S)-1-[[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butyl]amino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-[[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butyl]amino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-1-methyl-2-[[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butyl]amino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[(2S)-1-[[(2S)-3-methyl-2-(4-methyl-1-piperidin-1-iumyl)butyl]amino]-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-[[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butyl]amino]-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-[[(2S)-3-methyl-2-(4-methylpiperidin-1-ium-1-yl)butyl]amino]ethyl]thiophene-2-carboxamide Formula: C19H32N3O2S+ MolecularWeight: 366.54128

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C(C)NC(=O)C2=CC=CS2)C(C)C

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](CNC(=O)[C@H](C)NC(=O)C2=CC=CS2)C(C)C

InChI

InChI=1S/C19H31N3O2S/c1-13(2)16(22-9-7-14(3)8-10-22)12-20-18(23)15(4)21-19(24)17-6-5-11-25-17/h5-6,11,13-16H,7-10,12H2,1-4H3,(H,20,23)(H,21,24)/p+1/t15-,16+/m0/s1