ethyl 2-chloranyl-4-[2-(3,4-dimethoxyphenyl)sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 2-chloranyl-4-[2-(3,4-dimethoxyphenyl)sulfanylethanoylamino]benzoate Openeye Name: ethyl 2-chloro-4-[[2-(3,4-dimethoxyphenyl)sulfanylacetyl]amino]benzoate CAS Name: 2-chloro-4-[[2-[(3,4-dimethoxyphenyl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-chloro-4-[[2-(3,4-dimethoxyphenyl)sulfanylacetyl]amino]benzoate Traditional Name: 2-chloro-4-[[2-[(3,4-dimethoxyphenyl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C19H20ClNO5S MolecularWeight: 409.8838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)NC(=O)CSC2=CC(=C(C=C2)OC)OC)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)NC(=O)CSC2=CC(=C(C=C2)OC)OC)Cl

InChI

InChI=1S/C19H20ClNO5S/c1-4-26-19(23)14-7-5-12(9-15(14)20)21-18(22)11-27-13-6-8-16(24-2)17(10-13)25-3/h5-10H,4,11H2,1-3H3,(H,21,22)