2-methoxy-5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-methoxy-5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-methoxy-5-(1-phenyltetrazol-5-yl)sulfanyl-1,4-benzoquinone CAS Name: 2-methoxy-5-[(1-phenyl-5-tetrazolyl)thio]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-methoxy-5-(1-phenyltetrazol-5-yl)sulfanylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-methoxy-5-[(1-phenyltetrazol-5-yl)thio]-p-benzoquinone Formula: C14H10N4O3S MolecularWeight: 314.3192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(=CC1=O)SC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=O)C(=CC1=O)SC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C14H10N4O3S/c1-21-12-7-11(20)13(8-10(12)19)22-14-15-16-17-18(14)9-5-3-2-4-6-9/h2-8H,1H3