5-bromanyl-4-oxidanylidene-3-(3-phenylpropylsulfanylcarbonylamino)pentanoic acid

Systemtic Name: 5-bromanyl-4-oxidanylidene-3-(3-phenylpropylsulfanylcarbonylamino)pentanoic acid Openeye Name: 5-bromo-4-oxo-3-(3-phenylpropylsulfanylcarbonylamino)pentanoic acid CAS Name: 5-bromo-4-oxo-3-[[oxo-(3-phenylpropylthio)methyl]amino]pentanoic acid IUPAC Name: 5-bromo-4-oxo-3-(3-phenylpropylsulfanylcarbonylamino)pentanoic acid Traditional Name: 5-bromo-4-keto-3-[(3-phenylpropylthio)carbonylamino]valeric acid Formula: C15H18BrNO4S MolecularWeight: 388.27672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCSC(=O)NC(CC(=O)O)C(=O)CBr

Isomeric SMILES

C1=CC=C(C=C1)CCCSC(=O)NC(CC(=O)O)C(=O)CBr

InChI

InChI=1S/C15H18BrNO4S/c16-10-13(18)12(9-14(19)20)17-15(21)22-8-4-7-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,17,21)(H,19,20)