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

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-[4-(1-cyclopropylcarbonyl-2,3-dihydroindol-5-yl)-5-methyl-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-[4-[1-(cyclopropanecarbonyl)indolin-5-yl]-5-methyl-thiazol-2-yl]acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-[4-[1-[cyclopropyl(oxo)methyl]-2,3-dihydroindol-5-yl]-5-methyl-2-thiazolyl]acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-[4-[1-(cyclopropanecarbonyl)-2,3-dihydroindol-5-yl]-5-methyl-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-[4-[1-(cyclopropanecarbonyl)indolin-5-yl]-5-methyl-thiazol-2-yl]acetamide Formula: C24H31N4O2S+ MolecularWeight: 439.59354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C[NH+]2CCCCCC2)C3=CC4=C(C=C3)N(CC4)C(=O)C5CC5

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C[NH+]2CCCCCC2)C3=CC4=C(C=C3)N(CC4)C(=O)C5CC5

InChI

InChI=1S/C24H30N4O2S/c1-16-22(26-24(31-16)25-21(29)15-27-11-4-2-3-5-12-27)19-8-9-20-18(14-19)10-13-28(20)23(30)17-6-7-17/h8-9,14,17H,2-7,10-13,15H2,1H3,(H,25,26,29)/p+1