2-(2-pyrrolidin-1-ium-1-ylethoxy)benzenecarbothioamide

Systemtic Name: 2-(2-pyrrolidin-1-ium-1-ylethoxy)benzenecarbothioamide Openeye Name: 2-(2-pyrrolidin-1-ium-1-ylethoxy)benzenecarbothioamide CAS Name: 2-[2-(1-pyrrolidin-1-iumyl)ethoxy]benzenecarbothioamide IUPAC Name: 2-(2-pyrrolidin-1-ium-1-ylethoxy)benzenecarbothioamide Traditional Name: 2-(2-pyrrolidin-1-ium-1-ylethoxy)thiobenzamide Formula: C13H19N2OS+ MolecularWeight: 251.36776

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC2=CC=CC=C2C(=S)N

Isomeric SMILES

C1CC[NH+](C1)CCOC2=CC=CC=C2C(=S)N

InChI

InChI=1S/C13H18N2OS/c14-13(17)11-5-1-2-6-12(11)16-10-9-15-7-3-4-8-15/h1-2,5-6H,3-4,7-10H2,(H2,14,17)/p+1