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

Systemtic Name: N-[4-(1-cyclopropylcarbonyl-2,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[4-[1-(cyclopropanecarbonyl)indolin-5-yl]thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[4-[1-[cyclopropyl(oxo)methyl]-2,3-dihydroindol-5-yl]-2-thiazolyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[4-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[4-[1-(cyclopropanecarbonyl)indolin-5-yl]thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C21H25N4O2S+ MolecularWeight: 397.5138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)N(CC4)C(=O)C5CC5

Isomeric SMILES

C1CC[NH+](C1)CC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)N(CC4)C(=O)C5CC5

InChI

InChI=1S/C21H24N4O2S/c26-19(12-24-8-1-2-9-24)23-21-22-17(13-28-21)15-5-6-18-16(11-15)7-10-25(18)20(27)14-3-4-14/h5-6,11,13-14H,1-4,7-10,12H2,(H,22,23,26)/p+1