propan-2-yl 2-[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: propan-2-yl 2-[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: isopropyl 2-[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[2-(2,4-dibromo-6-methylphenoxy)-1-oxoethyl]amino]-1,3-benzothiazole-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[2-(2,4-dibromo-6-methylphenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylic acid isopropyl ester Formula: C20H18Br2N2O4S MolecularWeight: 542.24092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC(C)C)Br)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC(C)C)Br)Br

InChI

InChI=1S/C20H18Br2N2O4S/c1-10(2)28-19(26)12-4-5-15-16(7-12)29-20(23-15)24-17(25)9-27-18-11(3)6-13(21)8-14(18)22/h4-8,10H,9H2,1-3H3,(H,23,24,25)