N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-2-bromanyl-benzamide

Systemtic Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-2-bromanyl-benzamide Openeye Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-2-bromo-benzamide CAS Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-2-bromobenzamide IUPAC Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-2-bromobenzamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-bromo-benzamide Formula: C21H15BrN2OS MolecularWeight: 423.3256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3)Br

InChI

InChI=1S/C21H15BrN2OS/c22-17-6-2-1-5-16(17)20(25)23-13-14-9-11-15(12-10-14)21-24-18-7-3-4-8-19(18)26-21/h1-12H,13H2,(H,23,25)