N1-[4-[2-(4-ethylsulfanylphenyl)sulfonylpropanoylamino]-2-oxidanyl-phenyl]-N4,N4-dimethyl-benzene-1,4-dicarboxamide

Systemtic Name: N1-[4-[2-(4-ethylsulfanylphenyl)sulfonylpropanoylamino]-2-oxidanyl-phenyl]-N4,N4-dimethyl-benzene-1,4-dicarboxamide Openeye Name: N1-[4-[2-(4-ethylsulfanylphenyl)sulfonylpropanoylamino]-2-hydroxy-phenyl]-N4,N4-dimethyl-terephthalamide CAS Name: N1-[4-[[2-[4-(ethylthio)phenyl]sulfonyl-1-oxopropyl]amino]-2-hydroxyphenyl]-N4,N4-dimethylbenzene-1,4-dicarboxamide IUPAC Name: 1-N-[4-[2-(4-ethylsulfanylphenyl)sulfonylpropanoylamino]-2-hydroxyphenyl]-4-N,4-N-dimethylbenzene-1,4-dicarboxamide Traditional Name: N-[4-[2-[4-(ethylthio)phenyl]sulfonylpropanoylamino]-2-hydroxy-phenyl]-N',N'-dimethyl-terephthalamide Formula: C27H29N3O6S2 MolecularWeight: 555.66566

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)S(=O)(=O)C(C)C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)N(C)C)O

Isomeric SMILES

CCSC1=CC=C(C=C1)S(=O)(=O)C(C)C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)N(C)C)O

InChI

InChI=1S/C27H29N3O6S2/c1-5-37-21-11-13-22(14-12-21)38(35,36)17(2)25(32)28-20-10-15-23(24(31)16-20)29-26(33)18-6-8-19(9-7-18)27(34)30(3)4/h6-17,31H,5H2,1-4H3,(H,28,32)(H,29,33)