[2-methoxy-6-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2-methoxy-6-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-[(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-6-methoxy-phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-methoxy-6-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [2-methoxy-6-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-[(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-6-methoxy-phenyl] ester Formula: C21H19NO5S3 MolecularWeight: 461.57426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2OC)C=C3C(=O)N(C(=S)S3)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2OC)C=C3C(=O)N(C(=S)S3)CC=C

InChI

InChI=1S/C21H19NO5S3/c1-4-12-22-20(23)18(29-21(22)28)13-15-6-5-7-17(26-3)19(15)27-30(24,25)16-10-8-14(2)9-11-16/h4-11,13H,1,12H2,2-3H3