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3-[(3-cyclohexyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid

3-[(3-cyclohexyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid

Systemtic Name:3-[(3-cyclohexyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid
Openeye Name:3-[(3-cyclohexyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]benzoic acid
CAS Name:3-[(3-cyclohexyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]benzoic acid
IUPAC Name:3-[(3-cyclohexyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid
Traditional Name:3-[(3-cyclohexyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]benzoic acid
Formula: C17H17NO3S2
MolecularWeight: 347.45178
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CC3=CC(=CC=C3)C(=O)O)SC2=S


Isomeric SMILES

C1CCC(CC1)N2C(=O)C(=CC3=CC(=CC=C3)C(=O)O)SC2=S


InChI

InChI=1S/C17H17NO3S2/c19-15-14(10-11-5-4-6-12(9-11)16(20)21)23-17(22)18(15)13-7-2-1-3-8-13/h4-6,9-10,13H,1-3,7-8H2,(H,20,21)


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