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

Systemtic Name: N-[4-(1-cyclohexylcarbonyl-2,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[4-[1-(cyclohexanecarbonyl)indolin-5-yl]thiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[4-[1-[cyclohexyl(oxo)methyl]-2,3-dihydroindol-5-yl]-2-thiazolyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[4-[1-(cyclohexanecarbonyl)-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[4-[1-(cyclohexanecarbonyl)indolin-5-yl]thiazol-2-yl]-2-piperidin-1-ium-1-yl-acetamide Formula: C25H33N4O2S+ MolecularWeight: 453.62012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCC3=C2C=CC(=C3)C4=CSC(=N4)NC(=O)C[NH+]5CCCCC5

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCC3=C2C=CC(=C3)C4=CSC(=N4)NC(=O)C[NH+]5CCCCC5

InChI

InChI=1S/C25H32N4O2S/c30-23(16-28-12-5-2-6-13-28)27-25-26-21(17-32-25)19-9-10-22-20(15-19)11-14-29(22)24(31)18-7-3-1-4-8-18/h9-10,15,17-18H,1-8,11-14,16H2,(H,26,27,30)/p+1