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

Systemtic Name: N-(3-carbamothioylphenyl)-3-pyrrolidin-1-ium-1-yl-propanamide Openeye Name: N-(3-carbamothioylphenyl)-3-pyrrolidin-1-ium-1-yl-propanamide CAS Name: N-(3-carbamothioylphenyl)-3-(1-pyrrolidin-1-iumyl)propanamide IUPAC Name: N-(3-carbamothioylphenyl)-3-pyrrolidin-1-ium-1-ylpropanamide Traditional Name: 3-pyrrolidin-1-ium-1-yl-N-(3-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(=C2)C(=S)N

Isomeric SMILES

C1CC[NH+](C1)CCC(=O)NC2=CC=CC(=C2)C(=S)N

InChI

InChI=1S/C14H19N3OS/c15-14(19)11-4-3-5-12(10-11)16-13(18)6-9-17-7-1-2-8-17/h3-5,10H,1-2,6-9H2,(H2,15,19)(H,16,18)/p+1