N-(1,3-benzothiazol-2-ylmethyl)-2-(4-bromanylphenoxy)propanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-bromanylphenoxy)propanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-bromophenoxy)propanamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-bromophenoxy)propanamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-bromophenoxy)propanamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(4-bromophenoxy)propionamide Formula: C17H15BrN2O2S MolecularWeight: 391.2822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=NC2=CC=CC=C2S1)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C(=O)NCC1=NC2=CC=CC=C2S1)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN2O2S/c1-11(22-13-8-6-12(18)7-9-13)17(21)19-10-16-20-14-4-2-3-5-15(14)23-16/h2-9,11H,10H2,1H3,(H,19,21)