[2-(5-chloranyl-2-cyano-phenyl)sulfanyl-2-phenyl-ethyl]carbamic acid

Systemtic Name: [2-(5-chloranyl-2-cyano-phenyl)sulfanyl-2-phenyl-ethyl]carbamic acid Openeye Name: [2-(5-chloro-2-cyano-phenyl)sulfanyl-2-phenyl-ethyl]carbamic acid CAS Name: [2-[(5-chloro-2-cyanophenyl)thio]-2-phenylethyl]carbamic acid IUPAC Name: [2-(5-chloro-2-cyanophenyl)sulfanyl-2-phenylethyl]carbamic acid Traditional Name: [2-[(5-chloro-2-cyano-phenyl)thio]-2-phenyl-ethyl]carbamic acid Formula: C16H13ClN2O2S MolecularWeight: 332.80462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC(=O)O)SC2=C(C=CC(=C2)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(CNC(=O)O)SC2=C(C=CC(=C2)Cl)C#N

InChI

InChI=1S/C16H13ClN2O2S/c17-13-7-6-12(9-18)14(8-13)22-15(10-19-16(20)21)11-4-2-1-3-5-11/h1-8,15,19H,10H2,(H,20,21)