methyl 4-[[6-(2-hydroxyethylcarbamoyl)-1,3-benzothiazol-2-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[6-(2-hydroxyethylcarbamoyl)-1,3-benzothiazol-2-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[6-(2-hydroxyethylcarbamoyl)-1,3-benzothiazol-2-yl]carbamoyl]benzoate CAS Name: 4-[[[6-[(2-hydroxyethylamino)-oxomethyl]-1,3-benzothiazol-2-yl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[6-(2-hydroxyethylcarbamoyl)-1,3-benzothiazol-2-yl]carbamoyl]benzoate Traditional Name: 4-[[6-(2-hydroxyethylcarbamoyl)-1,3-benzothiazol-2-yl]carbamoyl]benzoic acid methyl ester Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NCCO

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NCCO

InChI

InChI=1S/C19H17N3O5S/c1-27-18(26)12-4-2-11(3-5-12)17(25)22-19-21-14-7-6-13(10-15(14)28-19)16(24)20-8-9-23/h2-7,10,23H,8-9H2,1H3,(H,20,24)(H,21,22,25)