4-oxidanyl-2-[[phenethyl(2-sulfanylethyl)carbamoyl]amino]butanoic acid

Systemtic Name: 4-oxidanyl-2-[[phenethyl(2-sulfanylethyl)carbamoyl]amino]butanoic acid Openeye Name: 4-hydroxy-2-[[phenethyl(2-sulfanylethyl)carbamoyl]amino]butanoic acid CAS Name: 4-hydroxy-2-[[[2-mercaptoethyl(phenethyl)amino]-oxomethyl]amino]butanoic acid IUPAC Name: 4-hydroxy-2-[[phenethyl(2-sulfanylethyl)carbamoyl]amino]butanoic acid Traditional Name: 4-hydroxy-2-[[2-mercaptoethyl(phenethyl)carbamoyl]amino]butyric acid Formula: C15H22N2O4S MolecularWeight: 326.41118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CCS)C(=O)NC(CCO)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCN(CCS)C(=O)NC(CCO)C(=O)O

InChI

InChI=1S/C15H22N2O4S/c18-10-7-13(14(19)20)16-15(21)17(9-11-22)8-6-12-4-2-1-3-5-12/h1-5,13,18,22H,6-11H2,(H,16,21)(H,19,20)