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methyl 4-[2-[(3E)-3-(3-butyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxidanylidene-indol-1-yl]ethanoylamino]benzoate

methyl 4-[2-[(3E)-3-(3-butyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxidanylidene-indol-1-yl]ethanoylamino]benzoate

Systemtic Name:methyl 4-[2-[(3E)-3-(3-butyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxidanylidene-indol-1-yl]ethanoylamino]benzoate
Openeye Name:methyl 4-[[2-[(3E)-3-(3-butyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)-2-oxo-indolin-1-yl]acetyl]amino]benzoate
CAS Name:4-[[2-[(3E)-3-(3-butyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-2-oxo-1-indolyl]-1-oxoethyl]amino]benzoic acid methyl ester
IUPAC Name:methyl 4-[[2-[(3E)-3-(3-butyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-2-oxoindol-1-yl]acetyl]amino]benzoate
Traditional Name:4-[[2-[(3E)-3-(3-butyl-4-keto-2-thioxo-thiazolidin-5-ylidene)-2-keto-indolin-1-yl]acetyl]amino]benzoic acid methyl ester
Formula: C25H23N3O5S2
MolecularWeight: 509.59722
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=C(C=C4)C(=O)OC)SC1=S


Isomeric SMILES

CCCCN1C(=O)/C(=C\2/C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=C(C=C4)C(=O)OC)/SC1=S


InChI

InChI=1S/C25H23N3O5S2/c1-3-4-13-27-23(31)21(35-25(27)34)20-17-7-5-6-8-18(17)28(22(20)30)14-19(29)26-16-11-9-15(10-12-16)24(32)33-2/h5-12H,3-4,13-14H2,1-2H3,(H,26,29)/b21-20+


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