4-[2-[(1E)-hexa-1,5-dienyl]phenyl]-4-(4-propylcyclohexyl)cyclohexa-2,5-diene-1-carbothioate

Systemtic Name: 4-[2-[(1E)-hexa-1,5-dienyl]phenyl]-4-(4-propylcyclohexyl)cyclohexa-2,5-diene-1-carbothioate Openeye Name: 4-[2-[(1E)-hexa-1,5-dienyl]phenyl]-4-(4-propylcyclohexyl)cyclohexa-2,5-diene-1-carbothioate CAS Name: 4-[2-[(1E)-hexa-1,5-dienyl]phenyl]-4-(4-propylcyclohexyl)-1-cyclohexa-2,5-dienecarbothioate IUPAC Name: 4-[2-[(1E)-hexa-1,5-dienyl]phenyl]-4-(4-propylcyclohexyl)cyclohexa-2,5-diene-1-carbothioate Traditional Name: 4-[2-[(1E)-hexa-1,5-dienyl]phenyl]-4-(4-propylcyclohexyl)cyclohexa-2,5-diene-1-carbothioate Formula: C28H35OS- MolecularWeight: 419.6419

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2(C=CC(C=C2)C(=S)[O-])C3=CC=CC=C3C=CCCC=C

Isomeric SMILES

CCCC1CCC(CC1)C2(C=CC(C=C2)C(=S)[O-])C3=CC=CC=C3/C=C/CCC=C

InChI

InChI=1S/C28H36OS/c1-3-5-6-7-11-23-12-8-9-13-26(23)28(20-18-24(19-21-28)27(29)30)25-16-14-22(10-4-2)15-17-25/h3,7-9,11-13,18-22,24-25H,1,4-6,10,14-17H2,2H3,(H,29,30)/p-1/b11-7+