(4E)-4-[(4-methylpiperazin-1-yl)methylidene]-2,3-dihydro-1-benzothiepin-5-one

Systemtic Name: (4E)-4-[(4-methylpiperazin-1-yl)methylidene]-2,3-dihydro-1-benzothiepin-5-one Openeye Name: (4E)-4-[(4-methylpiperazin-1-yl)methylene]-2,3-dihydro-1-benzothiepin-5-one CAS Name: (4E)-4-[(4-methyl-1-piperazinyl)methylidene]-2,3-dihydro-1-benzothiepin-5-one IUPAC Name: (4E)-4-[(4-methylpiperazin-1-yl)methylidene]-2,3-dihydro-1-benzothiepin-5-one Traditional Name: (4E)-4-[(4-methylpiperazino)methylene]-2,3-dihydro-1-benzothiepin-5-one Formula: C16H20N2OS MolecularWeight: 288.4078

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C=C2CCSC3=CC=CC=C3C2=O

Isomeric SMILES

CN1CCN(CC1)/C=C/2\CCSC3=CC=CC=C3C2=O

InChI

InChI=1S/C16H20N2OS/c1-17-7-9-18(10-8-17)12-13-6-11-20-15-5-3-2-4-14(15)16(13)19/h2-5,12H,6-11H2,1H3/b13-12+