(6E)-3-octyl-6-(5-undecyl-1H-pyrimidin-2-ylidene)cyclohexa-2,4-diene-1-thione

Systemtic Name: (6E)-3-octyl-6-(5-undecyl-1H-pyrimidin-2-ylidene)cyclohexa-2,4-diene-1-thione Openeye Name: (6E)-3-octyl-6-(5-undecyl-1H-pyrimidin-2-ylidene)cyclohexa-2,4-diene-1-thione CAS Name: (6E)-3-octyl-6-(5-undecyl-1H-pyrimidin-2-ylidene)-1-cyclohexa-2,4-dienethione IUPAC Name: (6E)-3-octyl-6-(5-undecyl-1H-pyrimidin-2-ylidene)cyclohexa-2,4-diene-1-thione Traditional Name: (6E)-3-octyl-6-(5-undecyl-1H-pyrimidin-2-ylidene)cyclohexa-2,4-diene-1-thione Formula: C29H46N2S MolecularWeight: 454.75394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CNC(=C2C=CC(=CC2=S)CCCCCCCC)N=C1

Isomeric SMILES

CCCCCCCCCCCC1=CN/C(=C\2/C=CC(=CC2=S)CCCCCCCC)/N=C1

InChI

InChI=1S/C29H46N2S/c1-3-5-7-9-11-12-13-15-17-19-26-23-30-29(31-24-26)27-21-20-25(22-28(27)32)18-16-14-10-8-6-4-2/h20-24,30H,3-19H2,1-2H3/b29-27+