methyl 2-[[3-(2-methylpropoxy)phenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[[3-(2-methylpropoxy)phenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[(3-isobutoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[3-(2-methylpropoxy)phenyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[[3-(2-methylpropoxy)benzoyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(3-isobutoxybenzoyl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H20N2O4S/c1-12(2)11-26-15-6-4-5-13(9-15)18(23)22-20-21-16-8-7-14(19(24)25-3)10-17(16)27-20/h4-10,12H,11H2,1-3H3,(H,21,22,23)