[2-chloranyl-6-ethoxy-4-[(Z)-(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 3-methylbenzoate

Systemtic Name: [2-chloranyl-6-ethoxy-4-[(Z)-(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 3-methylbenzoate Openeye Name: [4-[(Z)-(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-2-chloro-6-ethoxy-phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [2-chloro-6-ethoxy-4-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-5-thiazolidinylidene)methyl]phenyl] ester IUPAC Name: [2-chloro-6-ethoxy-4-[(Z)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-[(Z)-(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-2-chloro-6-ethoxy-phenyl] ester Formula: C23H20ClNO4S2 MolecularWeight: 473.9922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)CC=C)Cl)OC(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C23H20ClNO4S2/c1-4-9-25-21(26)19(31-23(25)30)13-15-11-17(24)20(18(12-15)28-5-2)29-22(27)16-8-6-7-14(3)10-16/h4,6-8,10-13H,1,5,9H2,2-3H3/b19-13-