butyl 2-[2-(2,3-dimethylphenoxy)ethanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: butyl 2-[2-(2,3-dimethylphenoxy)ethanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: butyl 2-[[2-(2,3-dimethylphenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[2-(2,3-dimethylphenoxy)-1-oxoethyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester IUPAC Name: butyl 2-[[2-(2,3-dimethylphenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-(2,3-dimethylphenoxy)acetyl]amino]-1,3-benzothiazole-6-carboxylic acid butyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=CC=CC(=C3C)C

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=CC=CC(=C3C)C

InChI

InChI=1S/C22H24N2O4S/c1-4-5-11-27-21(26)16-9-10-17-19(12-16)29-22(23-17)24-20(25)13-28-18-8-6-7-14(2)15(18)3/h6-10,12H,4-5,11,13H2,1-3H3,(H,23,24,25)