[4-[3,5-bis(ethylsulfanyl)phenyl]sulfonylphenyl]carbamic acid

Systemtic Name: [4-[3,5-bis(ethylsulfanyl)phenyl]sulfonylphenyl]carbamic acid Openeye Name: [4-[3,5-bis(ethylsulfanyl)phenyl]sulfonylphenyl]carbamic acid CAS Name: [4-[3,5-bis(ethylthio)phenyl]sulfonylphenyl]carbamic acid IUPAC Name: [4-[3,5-bis(ethylsulfanyl)phenyl]sulfonylphenyl]carbamic acid Traditional Name: [4-[3,5-bis(ethylthio)phenyl]sulfonylphenyl]carbamic acid Formula: C17H19NO4S3 MolecularWeight: 397.53206

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC(=CC(=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)O)SCC

Isomeric SMILES

CCSC1=CC(=CC(=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)O)SCC

InChI

InChI=1S/C17H19NO4S3/c1-3-23-13-9-14(24-4-2)11-16(10-13)25(21,22)15-7-5-12(6-8-15)18-17(19)20/h5-11,18H,3-4H2,1-2H3,(H,19,20)