2-(4-bromanylphenoxy)-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]acetamide Formula: C23H18BrN3O2S2 MolecularWeight: 512.44192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(=O)COC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(=O)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C23H18BrN3O2S2/c1-14-2-11-19-20(12-14)31-22(26-19)15-3-7-17(8-4-15)25-23(30)27-21(28)13-29-18-9-5-16(24)6-10-18/h2-12H,13H2,1H3,(H2,25,27,28,30)