2,5-dibutoxy-6-diazo-3-(2-methylphenyl)sulfanyl-cyclohexa-1,3-diene

Systemtic Name: 2,5-dibutoxy-6-diazo-3-(2-methylphenyl)sulfanyl-cyclohexa-1,3-diene Openeye Name: 2,5-dibutoxy-6-diazo-3-(o-tolylsulfanyl)cyclohexa-1,3-diene CAS Name: 2,5-dibutoxy-6-diazo-3-[(2-methylphenyl)thio]cyclohexa-1,3-diene IUPAC Name: 2,5-dibutoxy-6-diazo-3-(2-methylphenyl)sulfanylcyclohexa-1,3-diene Traditional Name: 2,5-dibutoxy-6-diazo-3-(o-tolylthio)cyclohexa-1,3-diene Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1C=C(C(=CC1=[N+]=[N-])OCCCC)SC2=CC=CC=C2C

Isomeric SMILES

CCCCOC1C=C(C(=CC1=[N+]=[N-])OCCCC)SC2=CC=CC=C2C

InChI

InChI=1S/C21H28N2O2S/c1-4-6-12-24-18-15-21(26-20-11-9-8-10-16(20)3)19(14-17(18)23-22)25-13-7-5-2/h8-11,14-15,18H,4-7,12-13H2,1-3H3