propan-2-yl 2-[2-(2-chloranyl-4,6-dimethyl-phenoxy)ethanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: propan-2-yl 2-[2-(2-chloranyl-4,6-dimethyl-phenoxy)ethanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: isopropyl 2-[[2-(2-chloro-4,6-dimethyl-phenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[2-(2-chloro-4,6-dimethylphenoxy)-1-oxoethyl]amino]-1,3-benzothiazole-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[2-(2-chloro-4,6-dimethylphenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-(2-chloro-4,6-dimethyl-phenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylic acid isopropyl ester Formula: C21H21ClN2O4S MolecularWeight: 432.92044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC(C)C)C

InChI

InChI=1S/C21H21ClN2O4S/c1-11(2)28-20(26)14-5-6-16-17(9-14)29-21(23-16)24-18(25)10-27-19-13(4)7-12(3)8-15(19)22/h5-9,11H,10H2,1-4H3,(H,23,24,25)