N-(2-carbamothioylphenyl)-3-pyrrolidin-1-ium-1-yl-propanamide

Systemtic Name: N-(2-carbamothioylphenyl)-3-pyrrolidin-1-ium-1-yl-propanamide Openeye Name: N-(2-carbamothioylphenyl)-3-pyrrolidin-1-ium-1-yl-propanamide CAS Name: N-(2-carbamothioylphenyl)-3-(1-pyrrolidin-1-iumyl)propanamide IUPAC Name: N-(2-carbamothioylphenyl)-3-pyrrolidin-1-ium-1-ylpropanamide Traditional Name: 3-pyrrolidin-1-ium-1-yl-N-(2-thiocarbamoylphenyl)propionamide Formula: C14H20N3OS+ MolecularWeight: 278.3931

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCC(=O)NC2=CC=CC=C2C(=S)N

Isomeric SMILES

C1CC[NH+](C1)CCC(=O)NC2=CC=CC=C2C(=S)N

InChI

InChI=1S/C14H19N3OS/c15-14(19)11-5-1-2-6-12(11)16-13(18)7-10-17-8-3-4-9-17/h1-2,5-6H,3-4,7-10H2,(H2,15,19)(H,16,18)/p+1