2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]ethanone

Systemtic Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]ethanone Openeye Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-[5-(2-methylthiazol-4-yl)indolin-1-yl]ethanone CAS Name: 2-[(2S)-2-methyl-1-piperidin-1-iumyl]-1-[5-(2-methyl-4-thiazolyl)-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-[5-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydroindol-1-yl]ethanone Traditional Name: 2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-[5-(2-methylthiazol-4-yl)indolin-1-yl]ethanone Formula: C20H26N3OS+ MolecularWeight: 356.50494

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(=O)N2CCC3=C2C=CC(=C3)C4=CSC(=N4)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC(=O)N2CCC3=C2C=CC(=C3)C4=CSC(=N4)C

InChI

InChI=1S/C20H25N3OS/c1-14-5-3-4-9-22(14)12-20(24)23-10-8-17-11-16(6-7-19(17)23)18-13-25-15(2)21-18/h6-7,11,13-14H,3-5,8-10,12H2,1-2H3/p+1/t14-/m0/s1