5,7-dimethoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-1H-indole-2-carboxamide

Systemtic Name: 5,7-dimethoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-1H-indole-2-carboxamide Openeye Name: 5,7-dimethoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]thiazol-2-yl]-1H-indole-2-carboxamide CAS Name: 5,7-dimethoxy-N-[4-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-2-thiazolyl]-1H-indole-2-carboxamide IUPAC Name: 5,7-dimethoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]-1H-indole-2-carboxamide Traditional Name: 5,7-dimethoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]thiazol-2-yl]-1H-indole-2-carboxamide Formula: C21H27N4O3S+ MolecularWeight: 415.52908

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=CSC(=N2)NC(=O)C3=CC4=CC(=CC(=C4N3)OC)OC

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=CSC(=N2)NC(=O)C3=CC4=CC(=CC(=C4N3)OC)OC

InChI

InChI=1S/C21H26N4O3S/c1-13-5-4-6-25(10-13)11-15-12-29-21(22-15)24-20(26)17-8-14-7-16(27-2)9-18(28-3)19(14)23-17/h7-9,12-13,23H,4-6,10-11H2,1-3H3,(H,22,24,26)/p+1/t13-/m0/s1