4-[methyl-[(4-methylsulfanylphenyl)carbamoyl]amino]butanoic acid

Systemtic Name: 4-[methyl-[(4-methylsulfanylphenyl)carbamoyl]amino]butanoic acid Openeye Name: 4-[methyl-[(4-methylsulfanylphenyl)carbamoyl]amino]butanoic acid CAS Name: 4-[methyl-[[4-(methylthio)anilino]-oxomethyl]amino]butanoic acid IUPAC Name: 4-[methyl-[(4-methylsulfanylphenyl)carbamoyl]amino]butanoic acid Traditional Name: 4-[methyl-[[4-(methylthio)phenyl]carbamoyl]amino]butyric acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)NC1=CC=C(C=C1)SC

Isomeric SMILES

CN(CCCC(=O)O)C(=O)NC1=CC=C(C=C1)SC

InChI

InChI=1S/C13H18N2O3S/c1-15(9-3-4-12(16)17)13(18)14-10-5-7-11(19-2)8-6-10/h5-8H,3-4,9H2,1-2H3,(H,14,18)(H,16,17)