3-[(3-ethylphenyl)sulfonylamino]-5-ethylsulfanyl-4-oxidanylidene-pentanoic acid

Systemtic Name: 3-[(3-ethylphenyl)sulfonylamino]-5-ethylsulfanyl-4-oxidanylidene-pentanoic acid Openeye Name: 3-[(3-ethylphenyl)sulfonylamino]-5-ethylsulfanyl-4-oxo-pentanoic acid CAS Name: 3-[(3-ethylphenyl)sulfonylamino]-5-(ethylthio)-4-oxopentanoic acid IUPAC Name: 3-[(3-ethylphenyl)sulfonylamino]-5-ethylsulfanyl-4-oxopentanoic acid Traditional Name: 3-[(3-ethylphenyl)sulfonylamino]-5-(ethylthio)-4-keto-valeric acid Formula: C15H21NO5S2 MolecularWeight: 359.46094

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)S(=O)(=O)NC(CC(=O)O)C(=O)CSCC

Isomeric SMILES

CCC1=CC(=CC=C1)S(=O)(=O)NC(CC(=O)O)C(=O)CSCC

InChI

InChI=1S/C15H21NO5S2/c1-3-11-6-5-7-12(8-11)23(20,21)16-13(9-15(18)19)14(17)10-22-4-2/h5-8,13,16H,3-4,9-10H2,1-2H3,(H,18,19)