N,2-dimethyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N,2-dimethyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1,3-thiazole-4-carboxamide Openeye Name: N,2-dimethyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]thiazole-4-carboxamide CAS Name: N,2-dimethyl-N-[(3S)-1-phenethyl-3-piperidin-1-iumyl]-4-thiazolecarboxamide IUPAC Name: N,2-dimethyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1,3-thiazole-4-carboxamide Traditional Name: N,2-dimethyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]thiazole-4-carboxamide Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C(=O)N(C)C2CCC[NH+](C2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CS1)C(=O)N(C)[C@H]2CCC[NH+](C2)CCC3=CC=CC=C3

InChI

InChI=1S/C19H25N3OS/c1-15-20-18(14-24-15)19(23)21(2)17-9-6-11-22(13-17)12-10-16-7-4-3-5-8-16/h3-5,7-8,14,17H,6,9-13H2,1-2H3/p+1/t17-/m0/s1