(5-bromanyl-2-fluoranyl-phenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone

Systemtic Name: (5-bromanyl-2-fluoranyl-phenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Openeye Name: (5-bromo-2-fluoro-phenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone CAS Name: (5-bromo-2-fluorophenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone IUPAC Name: (5-bromo-2-fluorophenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Traditional Name: (5-bromo-2-fluoro-phenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Formula: C16H13BrFNOS MolecularWeight: 366.247923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)C3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C16H13BrFNOS/c17-11-6-7-13(18)12(10-11)16(20)19-8-3-9-21-15-5-2-1-4-14(15)19/h1-2,4-7,10H,3,8-9H2