2-methoxy-4-[(4-methylpiperazin-1-yl)-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2-methoxy-4-[(4-methylpiperazin-1-yl)-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2-methoxy-4-[(4-methylpiperazin-1-yl)-sulfanyl-methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[mercapto-(4-methyl-1-piperazinyl)methylidene]-2-methoxy-1-cyclohexa-2,5-dienone IUPAC Name: 2-methoxy-4-[(4-methylpiperazin-1-yl)-sulfanylmethylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[mercapto-(4-methylpiperazino)methylene]-2-methoxy-cyclohexa-2,5-dien-1-one Formula: C13H18N2O2S MolecularWeight: 266.35922

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=C2C=CC(=O)C(=C2)OC)S

Isomeric SMILES

CN1CCN(CC1)C(=C2C=CC(=O)C(=C2)OC)S

InChI

InChI=1S/C13H18N2O2S/c1-14-5-7-15(8-6-14)13(18)10-3-4-11(16)12(9-10)17-2/h3-4,9,18H,5-8H2,1-2H3