7-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 7-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 7-[4-(4-fluorophenyl)piperazino]sulfonyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C20H22FN3O3S MolecularWeight: 403.470383

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F)NC(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F)NC(=O)C1

InChI

InChI=1S/C20H22FN3O3S/c21-16-4-6-17(7-5-16)23-10-12-24(13-11-23)28(26,27)18-8-9-19-15(14-18)2-1-3-20(25)22-19/h4-9,14H,1-3,10-13H2,(H,22,25)