2-(4,5-dihydro-1,3-thiazol-3-ium-2-ylamino)-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone chloride

Systemtic Name: 2-(4,5-dihydro-1,3-thiazol-3-ium-2-ylamino)-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone chloride Openeye Name: 2-(4,5-dihydrothiazol-3-ium-2-ylamino)-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone chloride CAS Name: 2-(4,5-dihydrothiazol-3-ium-2-ylamino)-1-(5-methoxy-1,2-dimethyl-3-indolyl)ethanone chloride IUPAC Name: 2-(4,5-dihydro-1,3-thiazol-3-ium-2-ylamino)-1-(5-methoxy-1,2-dimethylindol-3-yl)ethanone chloride Traditional Name: 1-(5-methoxy-1,2-dimethyl-indol-3-yl)-2-(2-thiazolin-3-ium-2-ylamino)ethanone chloride Formula: C16H20ClN3O2S MolecularWeight: 353.8669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C)C=CC(=C2)OC)C(=O)CNC3=[NH+]CCS3.[Cl-]

Isomeric SMILES

CC1=C(C2=C(N1C)C=CC(=C2)OC)C(=O)CNC3=[NH+]CCS3.[Cl-]

InChI

InChI=1S/C16H19N3O2S.ClH/c1-10-15(14(20)9-18-16-17-6-7-22-16)12-8-11(21-3)4-5-13(12)19(10)2;/h4-5,8H,6-7,9H2,1-3H3,(H,17,18);1H