4-[4-[bis(methylsulfanyl)carbamoyl]phenyl]-3-methyl-4-oxidanyl-butanoic acid

Systemtic Name: 4-[4-[bis(methylsulfanyl)carbamoyl]phenyl]-3-methyl-4-oxidanyl-butanoic acid Openeye Name: 4-[4-[bis(methylsulfanyl)carbamoyl]phenyl]-4-hydroxy-3-methyl-butanoic acid CAS Name: 4-[4-[[bis(methylthio)amino]-oxomethyl]phenyl]-4-hydroxy-3-methylbutanoic acid IUPAC Name: 4-[4-[bis(methylsulfanyl)carbamoyl]phenyl]-4-hydroxy-3-methylbutanoic acid Traditional Name: 4-[4-[bis(methylthio)carbamoyl]phenyl]-4-hydroxy-3-methyl-butyric acid Formula: C14H19NO4S2 MolecularWeight: 329.43496

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C(C1=CC=C(C=C1)C(=O)N(SC)SC)O

Isomeric SMILES

CC(CC(=O)O)C(C1=CC=C(C=C1)C(=O)N(SC)SC)O

InChI

InChI=1S/C14H19NO4S2/c1-9(8-12(16)17)13(18)10-4-6-11(7-5-10)14(19)15(20-2)21-3/h4-7,9,13,18H,8H2,1-3H3,(H,16,17)