2-(4-bromanylphenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(4-bromophenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(4-bromophenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(4-bromophenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-benzyl-2-(4-bromophenoxy)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide Formula: C24H21BrN2O2S MolecularWeight: 481.40474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)COC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)COC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C24H21BrN2O2S/c1-16-12-17(2)23-21(13-16)30-24(26-23)27(14-18-6-4-3-5-7-18)22(28)15-29-20-10-8-19(25)9-11-20/h3-13H,14-15H2,1-2H3