3-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 3-[3-oxidanylidene-3-(4-phenylpiperazin-1-yl)propyl]sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 3-[[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 3-[[3-keto-3-(4-phenylpiperazino)propyl]thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2NC(=O)C1SCCC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CC2=CC=CC=C2NC(=O)C1SCCC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H27N3O2S/c27-22(26-15-13-25(14-16-26)19-7-2-1-3-8-19)12-17-29-21-11-10-18-6-4-5-9-20(18)24-23(21)28/h1-9,21H,10-17H2,(H,24,28)