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

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-thiophen-3-yl-1,3-thiazole-4-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(3-thienyl)thiazole-4-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2-(3-thiophenyl)-4-thiazolecarboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-2-thiophen-3-yl-1,3-thiazole-4-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(3-thienyl)thiazole-4-carboxamide Formula: C18H20N3O2S2+ MolecularWeight: 374.5003

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=CSC(=N2)C3=CSC=C3)C4=CC=CO4

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=CSC(=N2)C3=CSC=C3)C4=CC=CO4

InChI

InChI=1S/C18H19N3O2S2/c22-17(14-12-25-18(20-14)13-5-9-24-11-13)19-10-15(16-4-3-8-23-16)21-6-1-2-7-21/h3-5,8-9,11-12,15H,1-2,6-7,10H2,(H,19,22)/p+1/t15-/m0/s1