1-[4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzoxazepin-2-yl]ethanone

Systemtic Name: 1-[4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzoxazepin-2-yl]ethanone Openeye Name: 1-[4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzoxazepin-2-yl]ethanone CAS Name: 1-[4-(4-methyl-1-piperazinyl)-2-thieno[2,3-b][1,5]benzoxazepinyl]ethanone IUPAC Name: 1-[4-(4-methylpiperazin-1-yl)thieno[2,3-b][1,5]benzoxazepin-2-yl]ethanone Traditional Name: 1-[4-(4-methylpiperazino)thieno[2,3-b][1,5]benzoxazepin-2-yl]ethanone Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(S1)OC3=CC=CC=C3N=C2N4CCN(CC4)C

Isomeric SMILES

CC(=O)C1=CC2=C(S1)OC3=CC=CC=C3N=C2N4CCN(CC4)C

InChI

InChI=1S/C18H19N3O2S/c1-12(22)16-11-13-17(21-9-7-20(2)8-10-21)19-14-5-3-4-6-15(14)23-18(13)24-16/h3-6,11H,7-10H2,1-2H3