2-methyl-5-[(1-propyl-2,3-dihydro-1,2,3,4-tetrazol-5-yl)sulfanyl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-methyl-5-[(1-propyl-2,3-dihydro-1,2,3,4-tetrazol-5-yl)sulfanyl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-methyl-5-[(1-propyl-2,3-dihydrotetrazol-5-yl)sulfanyl]-1,4-benzoquinone CAS Name: 2-methyl-5-[(1-propyl-2,3-dihydrotetrazol-5-yl)thio]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-methyl-5-[(1-propyl-2,3-dihydrotetrazol-5-yl)sulfanyl]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2-methyl-5-[(1-propyl-2,3-dihydrotetrazol-5-yl)thio]-p-benzoquinone Formula: C11H14N4O2S MolecularWeight: 266.31946

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NNN1)SC2=CC(=O)C(=CC2=O)C

Isomeric SMILES

CCCN1C(=NNN1)SC2=CC(=O)C(=CC2=O)C

InChI

InChI=1S/C11H14N4O2S/c1-3-4-15-11(12-13-14-15)18-10-6-8(16)7(2)5-9(10)17/h5-6,13-14H,3-4H2,1-2H3