N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-thiazole-5-carboxamide

Systemtic Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-thiazole-5-carboxamide Openeye Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-methyl-2-(3,4,5-trimethoxyphenyl)thiazole-5-carboxamide CAS Name: N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-4-methyl-2-(3,4,5-trimethoxyphenyl)-5-thiazolecarboxamide IUPAC Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-methyl-2-(3,4,5-trimethoxyphenyl)-1,3-thiazole-5-carboxamide Traditional Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-methyl-2-(3,4,5-trimethoxyphenyl)thiazole-5-carboxamide Formula: C21H30N3O4S+ MolecularWeight: 420.5456

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=C(N=C(S2)C3=CC(=C(C(=C3)OC)OC)OC)C

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)C2=C(N=C(S2)C3=CC(=C(C(=C3)OC)OC)OC)C

InChI

InChI=1S/C21H29N3O4S/c1-6-24-9-7-8-15(24)12-22-20(25)19-13(2)23-21(29-19)14-10-16(26-3)18(28-5)17(11-14)27-4/h10-11,15H,6-9,12H2,1-5H3,(H,22,25)/p+1/t15-/m0/s1