methyl 2-[(3,4,5-triethoxyphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[(3,4,5-triethoxyphenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[(3,4,5-triethoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[oxo-(3,4,5-triethoxyphenyl)methyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(3,4,5-triethoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(3,4,5-triethoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H24N2O6S/c1-5-28-16-10-14(11-17(29-6-2)19(16)30-7-3)20(25)24-22-23-15-9-8-13(21(26)27-4)12-18(15)31-22/h8-12H,5-7H2,1-4H3,(H,23,24,25)