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

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methyl-2-thiophen-2-yl-1,3-thiazole-5-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methyl-2-(2-thienyl)thiazole-5-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-methyl-2-thiophen-2-yl-5-thiazolecarboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-4-methyl-2-thiophen-2-yl-1,3-thiazole-5-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-methyl-2-(2-thienyl)thiazole-5-carboxamide Formula: C19H22N3O2S2+ MolecularWeight: 388.52688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CS2)C(=O)NCC(C3=CC=CO3)[NH+]4CCCC4

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CS2)C(=O)NC[C@@H](C3=CC=CO3)[NH+]4CCCC4

InChI

InChI=1S/C19H21N3O2S2/c1-13-17(26-19(21-13)16-7-5-11-25-16)18(23)20-12-14(15-6-4-10-24-15)22-8-2-3-9-22/h4-7,10-11,14H,2-3,8-9,12H2,1H3,(H,20,23)/p+1/t14-/m0/s1