1-[2-[(3-methoxyphenyl)amino]-4-methyl-3-(3-morpholin-4-ylpropyl)-1,3-thiazol-3-ium-5-yl]ethanone

Systemtic Name: 1-[2-[(3-methoxyphenyl)amino]-4-methyl-3-(3-morpholin-4-ylpropyl)-1,3-thiazol-3-ium-5-yl]ethanone Openeye Name: 1-[2-(3-methoxyanilino)-4-methyl-3-(3-morpholinopropyl)thiazol-3-ium-5-yl]ethanone CAS Name: 1-[2-(3-methoxyanilino)-4-methyl-3-[3-(4-morpholinyl)propyl]-5-thiazol-3-iumyl]ethanone IUPAC Name: 1-[2-(3-methoxyanilino)-4-methyl-3-(3-morpholin-4-ylpropyl)-1,3-thiazol-3-ium-5-yl]ethanone Traditional Name: 1-[2-(m-anisidino)-4-methyl-3-(3-morpholinopropyl)thiazol-3-ium-5-yl]ethanone Formula: C20H28N3O3S+ MolecularWeight: 390.51962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=[N+]1CCCN2CCOCC2)NC3=CC(=CC=C3)OC)C(=O)C

Isomeric SMILES

CC1=C(SC(=[N+]1CCCN2CCOCC2)NC3=CC(=CC=C3)OC)C(=O)C

InChI

InChI=1S/C20H27N3O3S/c1-15-19(16(2)24)27-20(21-17-6-4-7-18(14-17)25-3)23(15)9-5-8-22-10-12-26-13-11-22/h4,6-7,14H,5,8-13H2,1-3H3/p+1