4-[(4-dimethylaminophenyl)carbamothioylsulfanyl]butanoic acid

Systemtic Name: 4-[(4-dimethylaminophenyl)carbamothioylsulfanyl]butanoic acid Openeye Name: 4-[(4-dimethylaminophenyl)carbamothioylsulfanyl]butanoic acid CAS Name: 4-[[[4-(dimethylamino)anilino]-sulfanylidenemethyl]thio]butanoic acid IUPAC Name: 4-[(4-dimethylaminophenyl)carbamothioylsulfanyl]butanoic acid Traditional Name: 4-[(4-dimethylaminophenyl)thiocarbamoylthio]butyric acid Formula: C13H18N2O2S2 MolecularWeight: 298.42422

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=S)SCCCC(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=S)SCCCC(=O)O

InChI

InChI=1S/C13H18N2O2S2/c1-15(2)11-7-5-10(6-8-11)14-13(18)19-9-3-4-12(16)17/h5-8H,3-4,9H2,1-2H3,(H,14,18)(H,16,17)