(4-bromophenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone

Systemtic Name: (4-bromophenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Openeye Name: (4-bromophenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone CAS Name: (4-bromophenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone IUPAC Name: (4-bromophenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Traditional Name: (4-bromophenyl)-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)methanone Formula: C16H14BrNOS MolecularWeight: 348.25746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrNOS/c17-13-8-6-12(7-9-13)16(19)18-10-3-11-20-15-5-2-1-4-14(15)18/h1-2,4-9H,3,10-11H2