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

Systemtic Name: N-[4-(1-cyclopropylcarbonyl-2,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[4-[1-(cyclopropanecarbonyl)indolin-5-yl]thiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[4-[1-[cyclopropyl(oxo)methyl]-2,3-dihydroindol-5-yl]-2-thiazolyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[4-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[4-[1-(cyclopropanecarbonyl)indolin-5-yl]thiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide Formula: C22H27N4O2S+ MolecularWeight: 411.54038

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)N(CC4)C(=O)C5CC5

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)N(CC4)C(=O)C5CC5

InChI

InChI=1S/C22H26N4O2S/c27-20(13-25-9-2-1-3-10-25)24-22-23-18(14-29-22)16-6-7-19-17(12-16)8-11-26(19)21(28)15-4-5-15/h6-7,12,14-15H,1-5,8-11,13H2,(H,23,24,27)/p+1