[2-methoxy-4-[(E)-(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] adamantane-1-carboxylate

Systemtic Name: [2-methoxy-4-[(E)-(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] adamantane-1-carboxylate Openeye Name: [2-methoxy-4-[(E)-(3-methyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-methoxy-4-[(E)-(3-methyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [4-[(E)-(4-keto-3-methyl-2-thioxo-thiazolidin-5-ylidene)methyl]-2-methoxy-phenyl] ester Formula: C23H25NO4S2 MolecularWeight: 443.5789

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC(=C(C=C2)OC(=O)C34CC5CC(C3)CC(C5)C4)OC)SC1=S

Isomeric SMILES

CN1C(=O)/C(=C\C2=CC(=C(C=C2)OC(=O)C34CC5CC(C3)CC(C5)C4)OC)/SC1=S

InChI

InChI=1S/C23H25NO4S2/c1-24-20(25)19(30-22(24)29)9-13-3-4-17(18(8-13)27-2)28-21(26)23-10-14-5-15(11-23)7-16(6-14)12-23/h3-4,8-9,14-16H,5-7,10-12H2,1-2H3/b19-9+