methyl 3,5-dimethyl-4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-benzothiazol-6-yl]carbonylamino]benzoate

Systemtic Name: methyl 3,5-dimethyl-4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-benzothiazol-6-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[2-(tert-butoxycarbonylamino)-1,3-benzothiazole-6-carbonyl]amino]-3,5-dimethyl-benzoate CAS Name: 3,5-dimethyl-4-[[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1,3-benzothiazol-6-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3,5-dimethyl-4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-1,3-benzothiazole-6-carbonyl]amino]benzoate Traditional Name: 4-[[2-(tert-butoxycarbonylamino)-1,3-benzothiazole-6-carbonyl]amino]-3,5-dimethyl-benzoic acid methyl ester Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)OC(C)(C)C)C)C(=O)OC

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)OC(C)(C)C)C)C(=O)OC

InChI

InChI=1S/C23H25N3O5S/c1-12-9-15(20(28)30-6)10-13(2)18(12)25-19(27)14-7-8-16-17(11-14)32-21(24-16)26-22(29)31-23(3,4)5/h7-11H,1-6H3,(H,25,27)(H,24,26,29)