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

Systemtic Name: 2-(4,5-dihydro-1,3-thiazol-3-ium-2-ylamino)-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone Openeye Name: 2-(4,5-dihydrothiazol-3-ium-2-ylamino)-1-(5-methoxy-1,2-dimethyl-indol-3-yl)ethanone CAS Name: 2-(4,5-dihydrothiazol-3-ium-2-ylamino)-1-(5-methoxy-1,2-dimethyl-3-indolyl)ethanone IUPAC Name: 2-(4,5-dihydro-1,3-thiazol-3-ium-2-ylamino)-1-(5-methoxy-1,2-dimethylindol-3-yl)ethanone Traditional Name: 1-(5-methoxy-1,2-dimethyl-indol-3-yl)-2-(2-thiazolin-3-ium-2-ylamino)ethanone Formula: C16H20N3O2S+ MolecularWeight: 318.4139

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O2S/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)/p+1