[4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-chloranyl-6-ethoxy-phenyl] 3,4-dimethoxybenzoate

Systemtic Name: [4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]-2-chloranyl-6-ethoxy-phenyl] 3,4-dimethoxybenzoate Openeye Name: [4-[(2-amino-4-oxo-thiazol-5-ylidene)methyl]-2-chloro-6-ethoxy-phenyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [4-[(2-amino-4-oxo-5-thiazolylidene)methyl]-2-chloro-6-ethoxyphenyl] ester IUPAC Name: [4-[(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]-2-chloro-6-ethoxyphenyl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [4-[(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]-2-chloro-6-ethoxy-phenyl] ester Formula: C21H19ClN2O6S MolecularWeight: 462.90336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN2O6S/c1-4-29-16-8-11(9-17-19(25)24-21(23)31-17)7-13(22)18(16)30-20(26)12-5-6-14(27-2)15(10-12)28-3/h5-10H,4H2,1-3H3,(H2,23,24,25)