N-[3-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]propyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[3-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]propyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide Openeye Name: N-[3-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]propyl]-4-methyl-2-phenyl-thiazole-5-carboxamide CAS Name: N-[3-[(2S,6S)-2,6-dimethyl-4-morpholin-4-iumyl]propyl]-4-methyl-2-phenyl-5-thiazolecarboxamide IUPAC Name: N-[3-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]propyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide Traditional Name: N-[3-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]propyl]-4-methyl-2-phenyl-thiazole-5-carboxamide Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CCCNC(=O)C2=C(N=C(S2)C3=CC=CC=C3)C

Isomeric SMILES

C[C@H]1C[NH+](C[C@@H](O1)C)CCCNC(=O)C2=C(N=C(S2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H27N3O2S/c1-14-12-23(13-15(2)25-14)11-7-10-21-19(24)18-16(3)22-20(26-18)17-8-5-4-6-9-17/h4-6,8-9,14-15H,7,10-13H2,1-3H3,(H,21,24)/p+1/t14-,15-/m0/s1