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

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-[4-(1-cyclohexylcarbonyl-2,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-[4-[1-(cyclohexanecarbonyl)indolin-5-yl]thiazol-2-yl]acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-[4-[1-[cyclohexyl(oxo)methyl]-2,3-dihydroindol-5-yl]-2-thiazolyl]acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-[4-[1-(cyclohexanecarbonyl)-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-[4-[1-(cyclohexanecarbonyl)indolin-5-yl]thiazol-2-yl]acetamide Formula: C26H35N4O2S+ MolecularWeight: 467.6467

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)N(CC4)C(=O)C5CCCCC5

Isomeric SMILES

C1CCC[NH+](CC1)CC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)N(CC4)C(=O)C5CCCCC5

InChI

InChI=1S/C26H34N4O2S/c31-24(17-29-13-6-1-2-7-14-29)28-26-27-22(18-33-26)20-10-11-23-21(16-20)12-15-30(23)25(32)19-8-4-3-5-9-19/h10-11,16,18-19H,1-9,12-15,17H2,(H,27,28,31)/p+1