N-[5-methyl-4-[1-(2-methylpropanoyl)-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]-2-pyrrolidin-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-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[5-methyl-4-[1-(2-methylpropanoyl)indolin-5-yl]thiazol-2-yl]-2-pyrrolidin-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-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[5-methyl-4-[1-(2-methylpropanoyl)-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[4-(1-isobutyrylindolin-5-yl)-5-methyl-thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C22H29N4O2S+ MolecularWeight: 413.55626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C[NH+]2CCCC2)C3=CC4=C(C=C3)N(CC4)C(=O)C(C)C

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C[NH+]2CCCC2)C3=CC4=C(C=C3)N(CC4)C(=O)C(C)C

InChI

InChI=1S/C22H28N4O2S/c1-14(2)21(28)26-11-8-16-12-17(6-7-18(16)26)20-15(3)29-22(24-20)23-19(27)13-25-9-4-5-10-25/h6-7,12,14H,4-5,8-11,13H2,1-3H3,(H,23,24,27)/p+1