[2-ethoxy-4-[(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzoate

Systemtic Name: [2-ethoxy-4-[(3-methyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzoate Openeye Name: [2-ethoxy-4-[(3-methyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-ethoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [2-ethoxy-4-[(3-methyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-ethoxy-4-[(4-keto-3-methyl-2-thioxo-thiazolidin-5-ylidene)methyl]phenyl] ester Formula: C21H19NO4S2 MolecularWeight: 413.50986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C)OC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C)OC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H19NO4S2/c1-4-25-17-11-14(12-18-19(23)22(3)21(27)28-18)7-10-16(17)26-20(24)15-8-5-13(2)6-9-15/h5-12H,4H2,1-3H3