methyl 3-azanyl-5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-4-oxidanyl-benzoate

Systemtic Name: methyl 3-azanyl-5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-4-oxidanyl-benzoate Openeye Name: methyl 3-amino-5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-4-hydroxy-benzoate CAS Name: 3-amino-5-[2-(3,4-diethoxyphenyl)-4-thiazolyl]-4-hydroxybenzoic acid methyl ester IUPAC Name: methyl 3-amino-5-[2-(3,4-diethoxyphenyl)-1,3-thiazol-4-yl]-4-hydroxybenzoate Traditional Name: 3-amino-5-[2-(3,4-diethoxyphenyl)thiazol-4-yl]-4-hydroxy-benzoic acid methyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=CC(=C3O)N)C(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)C3=CC(=CC(=C3O)N)C(=O)OC)OCC

InChI

InChI=1S/C21H22N2O5S/c1-4-27-17-7-6-12(10-18(17)28-5-2)20-23-16(11-29-20)14-8-13(21(25)26-3)9-15(22)19(14)24/h6-11,24H,4-5,22H2,1-3H3