4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoic acid

Systemtic Name: 4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoic acid Openeye Name: 4-methylsulfanyl-2-[[(E)-styryl]sulfonylamino]butanoic acid CAS Name: 4-(methylthio)-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoic acid IUPAC Name: 4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoic acid Traditional Name: 4-(methylthio)-2-[[(E)-styryl]sulfonylamino]butyric acid Formula: C13H17NO4S2 MolecularWeight: 315.40838

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NS(=O)(=O)C=CC1=CC=CC=C1

Isomeric SMILES

CSCCC(C(=O)O)NS(=O)(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C13H17NO4S2/c1-19-9-7-12(13(15)16)14-20(17,18)10-8-11-5-3-2-4-6-11/h2-6,8,10,12,14H,7,9H2,1H3,(H,15,16)/b10-8+