3-(3-methyl-4-oxidanyl-phenyl)sulfanyl-N-[2-[3-(3-methyl-4-oxidanyl-phenyl)sulfanylpropanoylamino]ethyl]propanamide

Systemtic Name: 3-(3-methyl-4-oxidanyl-phenyl)sulfanyl-N-[2-[3-(3-methyl-4-oxidanyl-phenyl)sulfanylpropanoylamino]ethyl]propanamide Openeye Name: 3-(4-hydroxy-3-methyl-phenyl)sulfanyl-N-[2-[3-(4-hydroxy-3-methyl-phenyl)sulfanylpropanoylamino]ethyl]propanamide CAS Name: 3-[(4-hydroxy-3-methylphenyl)thio]-N-[2-[[3-[(4-hydroxy-3-methylphenyl)thio]-1-oxopropyl]amino]ethyl]propanamide IUPAC Name: 3-(4-hydroxy-3-methylphenyl)sulfanyl-N-[2-[3-(4-hydroxy-3-methylphenyl)sulfanylpropanoylamino]ethyl]propanamide Traditional Name: 3-[(4-hydroxy-3-methyl-phenyl)thio]-N-[2-[3-[(4-hydroxy-3-methyl-phenyl)thio]propanoylamino]ethyl]propionamide Formula: C22H28N2O4S2 MolecularWeight: 448.59872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SCCC(=O)NCCNC(=O)CCSC2=CC(=C(C=C2)O)C)O

Isomeric SMILES

CC1=C(C=CC(=C1)SCCC(=O)NCCNC(=O)CCSC2=CC(=C(C=C2)O)C)O

InChI

InChI=1S/C22H28N2O4S2/c1-15-13-17(3-5-19(15)25)29-11-7-21(27)23-9-10-24-22(28)8-12-30-18-4-6-20(26)16(2)14-18/h3-6,13-14,25-26H,7-12H2,1-2H3,(H,23,27)(H,24,28)