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

Systemtic Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide Openeye Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methyl-2-(2-pyridyl)thiazole-5-carboxamide CAS Name: N-[(2S)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-methyl-2-(2-pyridinyl)-5-thiazolecarboxamide IUPAC Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide Traditional Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methyl-2-(2-pyridyl)thiazole-5-carboxamide Formula: C23H27N4O2S+ MolecularWeight: 423.55108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=N2)C(=O)NCC(C3=CC=C(C=C3)OC)[NH+]4CCCC4

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=N2)C(=O)NC[C@H](C3=CC=C(C=C3)OC)[NH+]4CCCC4

InChI

InChI=1S/C23H26N4O2S/c1-16-21(30-23(26-16)19-7-3-4-12-24-19)22(28)25-15-20(27-13-5-6-14-27)17-8-10-18(29-2)11-9-17/h3-4,7-12,20H,5-6,13-15H2,1-2H3,(H,25,28)/p+1/t20-/m1/s1