(4-ethylpiperazin-4-ium-1-yl)-[5-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-thiazol-4-yl]methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-[5-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-thiazol-4-yl]methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-[5-methyl-2-(3,4,5-trimethoxyphenyl)thiazol-4-yl]methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[5-methyl-2-(3,4,5-trimethoxyphenyl)-4-thiazolyl]methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-[5-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-thiazol-4-yl]methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-[5-methyl-2-(3,4,5-trimethoxyphenyl)thiazol-4-yl]methanone Formula: C20H28N3O4S+ MolecularWeight: 406.51902

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(SC(=N2)C3=CC(=C(C(=C3)OC)OC)OC)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(SC(=N2)C3=CC(=C(C(=C3)OC)OC)OC)C

InChI

InChI=1S/C20H27N3O4S/c1-6-22-7-9-23(10-8-22)20(24)17-13(2)28-19(21-17)14-11-15(25-3)18(27-5)16(12-14)26-4/h11-12H,6-10H2,1-5H3/p+1