2-(4-bromanylphenoxy)-2-methyl-N-[2-(propanoylamino)-1,3-benzothiazol-6-yl]propanamide

Systemtic Name: 2-(4-bromanylphenoxy)-2-methyl-N-[2-(propanoylamino)-1,3-benzothiazol-6-yl]propanamide Openeye Name: 2-(4-bromophenoxy)-2-methyl-N-[2-(propanoylamino)-1,3-benzothiazol-6-yl]propanamide CAS Name: 2-(4-bromophenoxy)-2-methyl-N-[2-(1-oxopropylamino)-1,3-benzothiazol-6-yl]propanamide IUPAC Name: 2-(4-bromophenoxy)-2-methyl-N-[2-(propanoylamino)-1,3-benzothiazol-6-yl]propanamide Traditional Name: 2-(4-bromophenoxy)-2-methyl-N-(2-propionamido-1,3-benzothiazol-6-yl)propionamide Formula: C20H20BrN3O3S MolecularWeight: 462.3601

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C(C)(C)OC3=CC=C(C=C3)Br

Isomeric SMILES

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C(C)(C)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C20H20BrN3O3S/c1-4-17(25)24-19-23-15-10-7-13(11-16(15)28-19)22-18(26)20(2,3)27-14-8-5-12(21)6-9-14/h5-11H,4H2,1-3H3,(H,22,26)(H,23,24,25)