sodium [4-[3-(5-methylsulfanyl-2-phenylmethoxy-phenyl)thiophen-2-yl]phenyl]carbonyl-thiophen-2-ylsulfonyl-azanide

Systemtic Name: sodium [4-[3-(5-methylsulfanyl-2-phenylmethoxy-phenyl)thiophen-2-yl]phenyl]carbonyl-thiophen-2-ylsulfonyl-azanide Openeye Name: sodium [4-[3-(2-benzyloxy-5-methylsulfanyl-phenyl)-2-thienyl]benzoyl]-(2-thienylsulfonyl)azanide CAS Name: sodium [[4-[3-[5-(methylthio)-2-phenylmethoxyphenyl]-2-thiophenyl]phenyl]-oxomethyl]-thiophen-2-ylsulfonylazanide IUPAC Name: sodium [4-[3-(5-methylsulfanyl-2-phenylmethoxyphenyl)thiophen-2-yl]benzoyl]-thiophen-2-ylsulfonylazanide Traditional Name: sodium [4-[3-[2-benzoxy-5-(methylthio)phenyl]-2-thienyl]benzoyl]-(2-thienylsulfonyl)azanide Formula: C29H22NNaO4S4 MolecularWeight: 599.73905

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(SC=C3)C4=CC=C(C=C4)C(=O)[N-]S(=O)(=O)C5=CC=CS5.[Na+]

Isomeric SMILES

CSC1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(SC=C3)C4=CC=C(C=C4)C(=O)[N-]S(=O)(=O)C5=CC=CS5.[Na+]

InChI

InChI=1S/C29H23NO4S4.Na/c1-35-23-13-14-26(34-19-20-6-3-2-4-7-20)25(18-23)24-15-17-37-28(24)21-9-11-22(12-10-21)29(31)30-38(32,33)27-8-5-16-36-27;/h2-18H,19H2,1H3,(H,30,31);/q;+1/p-1