2-[5-(5-bromanyl-1-methyl-2-oxidanylidene-indol-3-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid

Systemtic Name: 2-[5-(5-bromanyl-1-methyl-2-oxidanylidene-indol-3-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Openeye Name: 2-[5-(5-bromo-1-methyl-2-oxo-indolin-3-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid CAS Name: 2-[5-(5-bromo-1-methyl-2-oxo-3-indolylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]ethanesulfonic acid IUPAC Name: 2-[5-(5-bromo-1-methyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Traditional Name: 2-[5-(5-bromo-2-keto-1-methyl-indolin-3-ylidene)-4-keto-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid Formula: C14H11BrN2O5S3 MolecularWeight: 463.34654

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CCS(=O)(=O)O)C1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CCS(=O)(=O)O)C1=O

InChI

InChI=1S/C14H11BrN2O5S3/c1-16-9-3-2-7(15)6-8(9)10(12(16)18)11-13(19)17(14(23)24-11)4-5-25(20,21)22/h2-3,6H,4-5H2,1H3,(H,20,21,22)