4-(1,3-benzothiazol-2-yl)-N-[2-(4-bromanylphenoxy)ethyl]-N-methyl-butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(4-bromanylphenoxy)ethyl]-N-methyl-butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(4-bromophenoxy)ethyl]-N-methyl-butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(4-bromophenoxy)ethyl]-N-methylbutanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(4-bromophenoxy)ethyl]-N-methylbutanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(4-bromophenoxy)ethyl]-N-methyl-butyramide Formula: C20H21BrN2O2S MolecularWeight: 433.36194

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=C(C=C1)Br)C(=O)CCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)Br)C(=O)CCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H21BrN2O2S/c1-23(13-14-25-16-11-9-15(21)10-12-16)20(24)8-4-7-19-22-17-5-2-3-6-18(17)26-19/h2-3,5-6,9-12H,4,7-8,13-14H2,1H3