(3-ethanoylsulfanyl-3-phenyl-propyl)-methyl-carbamic acid

Systemtic Name: (3-ethanoylsulfanyl-3-phenyl-propyl)-methyl-carbamic acid Openeye Name: (3-acetylsulfanyl-3-phenyl-propyl)-methyl-carbamic acid CAS Name: [3-(acetylthio)-3-phenylpropyl]-methylcarbamic acid IUPAC Name: (3-acetylsulfanyl-3-phenylpropyl)-methylcarbamic acid Traditional Name: [3-(acetylthio)-3-phenyl-propyl]-methyl-carbamic acid Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3S/c1-10(15)18-12(8-9-14(2)13(16)17)11-6-4-3-5-7-11/h3-7,12H,8-9H2,1-2H3,(H,16,17)