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

Systemtic Name: sodium [4-[3-(5-bromanyl-2-phenylmethoxy-phenyl)thiophen-2-yl]phenyl]carbonyl-thiophen-2-ylsulfonyl-azanide Openeye Name: sodium [4-[3-(2-benzyloxy-5-bromo-phenyl)-2-thienyl]benzoyl]-(2-thienylsulfonyl)azanide CAS Name: sodium [[4-[3-(5-bromo-2-phenylmethoxyphenyl)-2-thiophenyl]phenyl]-oxomethyl]-thiophen-2-ylsulfonylazanide IUPAC Name: sodium [4-[3-(5-bromo-2-phenylmethoxyphenyl)thiophen-2-yl]benzoyl]-thiophen-2-ylsulfonylazanide Traditional Name: sodium [4-[3-(2-benzoxy-5-bromo-phenyl)-2-thienyl]benzoyl]-(2-thienylsulfonyl)azanide Formula: C28H19BrNNaO4S3 MolecularWeight: 632.54353

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C3=C(SC=C3)C4=CC=C(C=C4)C(=O)[N-]S(=O)(=O)C5=CC=CS5.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C3=C(SC=C3)C4=CC=C(C=C4)C(=O)[N-]S(=O)(=O)C5=CC=CS5.[Na+]

InChI

InChI=1S/C28H20BrNO4S3.Na/c29-22-12-13-25(34-18-19-5-2-1-3-6-19)24(17-22)23-14-16-36-27(23)20-8-10-21(11-9-20)28(31)30-37(32,33)26-7-4-15-35-26;/h1-17H,18H2,(H,30,31);/q;+1/p-1