N-[5-methyl-4-[1-(2-methylpropanoyl)-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[5-methyl-4-[1-(2-methylpropanoyl)-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[5-methyl-4-[1-(2-methylpropanoyl)indolin-5-yl]thiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[5-methyl-4-[1-(2-methyl-1-oxopropyl)-2,3-dihydroindol-5-yl]-2-thiazolyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[5-methyl-4-[1-(2-methylpropanoyl)-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[4-(1-isobutyrylindolin-5-yl)-5-methyl-thiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide Formula: C23H31N4O2S+ MolecularWeight: 427.58284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C[NH+]2CCCCC2)C3=CC4=C(C=C3)N(CC4)C(=O)C(C)C

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C[NH+]2CCCCC2)C3=CC4=C(C=C3)N(CC4)C(=O)C(C)C

InChI

InChI=1S/C23H30N4O2S/c1-15(2)22(29)27-12-9-17-13-18(7-8-19(17)27)21-16(3)30-23(25-21)24-20(28)14-26-10-5-4-6-11-26/h7-8,13,15H,4-6,9-12,14H2,1-3H3,(H,24,25,28)/p+1