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

Systemtic Name: (4-chloranyl-3-oxidanylidene-1-phenylsulfanyl-butan-2-yl)-(phenylmethyl)carbamic acid Openeye Name: benzyl-[3-chloro-2-oxo-1-(phenylsulfanylmethyl)propyl]carbamic acid CAS Name: [4-chloro-3-oxo-1-(phenylthio)butan-2-yl]-(phenylmethyl)carbamic acid IUPAC Name: benzyl-(4-chloro-3-oxo-1-phenylsulfanylbutan-2-yl)carbamic acid Traditional Name: benzyl-[3-chloro-2-keto-1-[(phenylthio)methyl]propyl]carbamic acid Formula: C18H18ClNO3S MolecularWeight: 363.85842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C(CSC2=CC=CC=C2)C(=O)CCl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN(C(CSC2=CC=CC=C2)C(=O)CCl)C(=O)O

InChI

InChI=1S/C18H18ClNO3S/c19-11-17(21)16(13-24-15-9-5-2-6-10-15)20(18(22)23)12-14-7-3-1-4-8-14/h1-10,16H,11-13H2,(H,22,23)