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

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)-4-chloranyl-phenyl]-3-bromanyl-propanamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-4-chloro-phenyl]-3-bromo-propanamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-3-bromopropanamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-3-bromopropanamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-4-chloro-phenyl]-3-bromo-propionamide Formula: C16H12BrClN2OS MolecularWeight: 395.70128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=C(C=CC(=C3)NC(=O)CCBr)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=C(C=CC(=C3)NC(=O)CCBr)Cl

InChI

InChI=1S/C16H12BrClN2OS/c17-8-7-15(21)19-10-5-6-12(18)11(9-10)16-20-13-3-1-2-4-14(13)22-16/h1-6,9H,7-8H2,(H,19,21)