N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-(3-bromanylphenoxy)-N-methyl-ethanamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-(3-bromanylphenoxy)-N-methyl-ethanamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-(3-bromophenoxy)-N-methyl-acetamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-(3-bromophenoxy)-N-methylacetamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-(3-bromophenoxy)-N-methylacetamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-(3-bromophenoxy)-N-methyl-acetamide Formula: C18H17BrN2O2S MolecularWeight: 405.30878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)COC3=CC(=CC=C3)Br

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)COC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H17BrN2O2S/c1-12(18-20-15-8-3-4-9-16(15)24-18)21(2)17(22)11-23-14-7-5-6-13(19)10-14/h3-10,12H,11H2,1-2H3/t12-/m1/s1