2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Openeye Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone CAS Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-[4-(4-fluorophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-[4-(4-fluorophenyl)piperazino]ethanone Formula: C21H24FN3OS MolecularWeight: 385.498163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)CC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H24FN3OS/c22-17-6-8-18(9-7-17)23-11-13-24(14-12-23)21(26)16-25-10-3-15-27-20-5-2-1-4-19(20)25/h1-2,4-9H,3,10-16H2