4-[(5Z)-5-(5-bromanyl-1-ethyl-2-oxidanylidene-indol-3-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid

Systemtic Name: 4-[(5Z)-5-(5-bromanyl-1-ethyl-2-oxidanylidene-indol-3-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Openeye Name: 4-[(5Z)-5-(5-bromo-1-ethyl-2-oxo-indolin-3-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]butanoic acid CAS Name: 4-[(5Z)-5-(5-bromo-1-ethyl-2-oxo-3-indolylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid IUPAC Name: 4-[(5Z)-5-(5-bromo-1-ethyl-2-oxoindol-3-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Traditional Name: 4-[(5Z)-5-(5-bromo-1-ethyl-2-keto-indolin-3-ylidene)-4-keto-2-thioxo-thiazolidin-3-yl]butyric acid Formula: C17H15BrN2O4S2 MolecularWeight: 455.346

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CCCC(=O)O)C1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Br)/C(=C/3\C(=O)N(C(=S)S3)CCCC(=O)O)/C1=O

InChI

InChI=1S/C17H15BrN2O4S2/c1-2-19-11-6-5-9(18)8-10(11)13(15(19)23)14-16(24)20(17(25)26-14)7-3-4-12(21)22/h5-6,8H,2-4,7H2,1H3,(H,21,22)/b14-13-