(2-phenylazanyl-1,3-thiazol-4-yl)methyl 2,3,4-trimethoxybenzoate

Systemtic Name: (2-phenylazanyl-1,3-thiazol-4-yl)methyl 2,3,4-trimethoxybenzoate Openeye Name: (2-anilinothiazol-4-yl)methyl 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid (2-anilino-4-thiazolyl)methyl ester IUPAC Name: (2-anilino-1,3-thiazol-4-yl)methyl 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid (2-anilinothiazol-4-yl)methyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)OCC2=CSC(=N2)NC3=CC=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)OCC2=CSC(=N2)NC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C20H20N2O5S/c1-24-16-10-9-15(17(25-2)18(16)26-3)19(23)27-11-14-12-28-20(22-14)21-13-7-5-4-6-8-13/h4-10,12H,11H2,1-3H3,(H,21,22)