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

Systemtic Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-4-(4-bromophenyl)-N-methyl-4-oxidanylidene-butanamide Openeye Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-4-(4-bromophenyl)-N-methyl-4-oxo-butanamide CAS Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-4-(4-bromophenyl)-N-methyl-4-oxobutanamide IUPAC Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-4-(4-bromophenyl)-N-methyl-4-oxobutanamide Traditional Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-4-(4-bromophenyl)-4-keto-N-methyl-butyramide Formula: C20H19BrN2O2S MolecularWeight: 431.34606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19BrN2O2S/c1-13(20-22-16-5-3-4-6-18(16)26-20)23(2)19(25)12-11-17(24)14-7-9-15(21)10-8-14/h3-10,13H,11-12H2,1-2H3