(4-chloranyl-3-oxidanylidene-1-phenylsulfanyl-butan-2-yl)-methyl-carbamic acid

Systemtic Name: (4-chloranyl-3-oxidanylidene-1-phenylsulfanyl-butan-2-yl)-methyl-carbamic acid Openeye Name: [3-chloro-2-oxo-1-(phenylsulfanylmethyl)propyl]-methyl-carbamic acid CAS Name: [4-chloro-3-oxo-1-(phenylthio)butan-2-yl]-methylcarbamic acid IUPAC Name: (4-chloro-3-oxo-1-phenylsulfanylbutan-2-yl)-methylcarbamic acid Traditional Name: [3-chloro-2-keto-1-[(phenylthio)methyl]propyl]-methyl-carbamic acid Formula: C12H14ClNO3S MolecularWeight: 287.76246

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CSC1=CC=CC=C1)C(=O)CCl)C(=O)O

Isomeric SMILES

CN(C(CSC1=CC=CC=C1)C(=O)CCl)C(=O)O

InChI

InChI=1S/C12H14ClNO3S/c1-14(12(16)17)10(11(15)7-13)8-18-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,16,17)