N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide Openeye Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methyl-2-phenyl-thiazole-5-carboxamide CAS Name: N-[(2R)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-methyl-2-phenyl-5-thiazolecarboxamide IUPAC Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide Traditional Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methyl-2-phenyl-thiazole-5-carboxamide Formula: C24H28N3O2S+ MolecularWeight: 422.56302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NCC(C3=CC=CC=C3OC)[NH+]4CCCC4

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)NC[C@@H](C3=CC=CC=C3OC)[NH+]4CCCC4

InChI

InChI=1S/C24H27N3O2S/c1-17-22(30-24(26-17)18-10-4-3-5-11-18)23(28)25-16-20(27-14-8-9-15-27)19-12-6-7-13-21(19)29-2/h3-7,10-13,20H,8-9,14-16H2,1-2H3,(H,25,28)/p+1/t20-/m0/s1