N-[2-(1,3-benzothiazol-2-yl)-4,6-bis(bromanyl)phenyl]propanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-4,6-bis(bromanyl)phenyl]propanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-4,6-dibromo-phenyl]propanamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-4,6-dibromophenyl]propanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-4,6-dibromophenyl]propanamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-4,6-dibromo-phenyl]propionamide Formula: C16H12Br2N2OS MolecularWeight: 440.15228

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(C=C(C=C1C2=NC3=CC=CC=C3S2)Br)Br

Isomeric SMILES

CCC(=O)NC1=C(C=C(C=C1C2=NC3=CC=CC=C3S2)Br)Br

InChI

InChI=1S/C16H12Br2N2OS/c1-2-14(21)20-15-10(7-9(17)8-11(15)18)16-19-12-5-3-4-6-13(12)22-16/h3-8H,2H2,1H3,(H,20,21)