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

Systemtic Name: N-[4-(1-cyclohexylcarbonyl-2,3-dihydroindol-5-yl)-1,3-thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[4-[1-(cyclohexanecarbonyl)indolin-5-yl]thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[4-[1-[cyclohexyl(oxo)methyl]-2,3-dihydroindol-5-yl]-2-thiazolyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[4-[1-(cyclohexanecarbonyl)-2,3-dihydroindol-5-yl]-1,3-thiazol-2-yl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[4-[1-(cyclohexanecarbonyl)indolin-5-yl]thiazol-2-yl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C24H31N4O2S+ MolecularWeight: 439.59354

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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+]5CCCC5

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCC3=C2C=CC(=C3)C4=CSC(=N4)NC(=O)C[NH+]5CCCC5

InChI

InChI=1S/C24H30N4O2S/c29-22(15-27-11-4-5-12-27)26-24-25-20(16-31-24)18-8-9-21-19(14-18)10-13-28(21)23(30)17-6-2-1-3-7-17/h8-9,14,16-17H,1-7,10-13,15H2,(H,25,26,29)/p+1