N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-benzoyl-4-bromophenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-1,3-benzothiazole-6-carboxamide Formula: C21H13BrN2O2S MolecularWeight: 437.30912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C21H13BrN2O2S/c22-15-7-9-17(16(11-15)20(25)13-4-2-1-3-5-13)24-21(26)14-6-8-18-19(10-14)27-12-23-18/h1-12H,(H,24,26)