(E)-[azanyl-[4-(5-bromanylpyridin-3-yl)sulfonyl-5-methylsulfanyl-thiophen-2-yl]methylidene]carbamic acid

Systemtic Name: (E)-[azanyl-[4-(5-bromanylpyridin-3-yl)sulfonyl-5-methylsulfanyl-thiophen-2-yl]methylidene]carbamic acid Openeye Name: (E)-[amino-[4-[(5-bromo-3-pyridyl)sulfonyl]-5-methylsulfanyl-2-thienyl]methylene]carbamic acid CAS Name: (E)-[amino-[4-[(5-bromo-3-pyridinyl)sulfonyl]-5-(methylthio)-2-thiophenyl]methylidene]carbamic acid IUPAC Name: (E)-[amino-[4-(5-bromopyridin-3-yl)sulfonyl-5-methylsulfanylthiophen-2-yl]methylidene]carbamic acid Traditional Name: (E)-[amino-[4-[(5-bromo-3-pyridyl)sulfonyl]-5-(methylthio)-2-thienyl]methylene]carbamic acid Formula: C12H10BrN3O4S3 MolecularWeight: 436.3245

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C(=NC(=O)O)N)S(=O)(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CSC1=C(C=C(S1)/C(=N\C(=O)O)/N)S(=O)(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C12H10BrN3O4S3/c1-21-11-9(3-8(22-11)10(14)16-12(17)18)23(19,20)7-2-6(13)4-15-5-7/h2-5H,1H3,(H2,14,16)(H,17,18)