2-[4-(1,3-benzothiazol-2-yl)-5-bromanyl-2-ethoxy-phenoxy]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzothiazol-2-yl)-5-bromanyl-2-ethoxy-phenoxy]-N-(phenylmethyl)ethanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)-5-bromo-2-ethoxy-phenoxy]-N-benzyl-acetamide CAS Name: 2-[4-(1,3-benzothiazol-2-yl)-5-bromo-2-ethoxyphenoxy]-N-(phenylmethyl)acetamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-yl)-5-bromo-2-ethoxyphenoxy]-N-benzylacetamide Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)-5-bromo-2-ethoxy-phenoxy]-N-benzyl-acetamide Formula: C24H21BrN2O3S MolecularWeight: 497.40414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C2=NC3=CC=CC=C3S2)Br)OCC(=O)NCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C2=NC3=CC=CC=C3S2)Br)OCC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H21BrN2O3S/c1-2-29-20-12-17(24-27-19-10-6-7-11-22(19)31-24)18(25)13-21(20)30-15-23(28)26-14-16-8-4-3-5-9-16/h3-13H,2,14-15H2,1H3,(H,26,28)