5-[[3-(4-methylpiperazin-1-yl)pyridin-2-yl]oxymethyl]cyclohexa-2,4-diene-1-thione

Systemtic Name: 5-[[3-(4-methylpiperazin-1-yl)pyridin-2-yl]oxymethyl]cyclohexa-2,4-diene-1-thione Openeye Name: 5-[[3-(4-methylpiperazin-1-yl)-2-pyridyl]oxymethyl]cyclohexa-2,4-diene-1-thione CAS Name: 5-[[3-(4-methyl-1-piperazinyl)-2-pyridinyl]oxymethyl]-1-cyclohexa-2,4-dienethione IUPAC Name: 5-[[3-(4-methylpiperazin-1-yl)pyridin-2-yl]oxymethyl]cyclohexa-2,4-diene-1-thione Traditional Name: 5-[[3-(4-methylpiperazino)-2-pyridyl]oxymethyl]cyclohexa-2,4-diene-1-thione Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(N=CC=C2)OCC3=CC=CC(=S)C3

Isomeric SMILES

CN1CCN(CC1)C2=C(N=CC=C2)OCC3=CC=CC(=S)C3

InChI

InChI=1S/C17H21N3OS/c1-19-8-10-20(11-9-19)16-6-3-7-18-17(16)21-13-14-4-2-5-15(22)12-14/h2-7H,8-13H2,1H3