2-methylpropyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenoxy]carbonylcarbamate

Systemtic Name: 2-methylpropyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenoxy]carbonylcarbamate Openeye Name: isobutyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenoxy]carbonylcarbamate CAS Name: N-[[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenoxy]-oxomethyl]carbamic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenoxy]carbonylcarbamate Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenoxy]carbonylcarbamic acid isobutyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)OC(=O)NC(=O)OCC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)OC(=O)NC(=O)OCC(C)C

InChI

InChI=1S/C21H22N2O5S/c1-13(2)11-27-20(24)23-21(25)28-17-9-8-15(10-14(17)3)26-12-19-22-16-6-4-5-7-18(16)29-19/h4-10,13H,11-12H2,1-3H3,(H,23,24,25)