2,6-ditert-butyl-4-(6-octylsulfanyl-4-sulfanylidene-1H-1,3,5-triazin-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-ditert-butyl-4-(6-octylsulfanyl-4-sulfanylidene-1H-1,3,5-triazin-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 2,6-ditert-butyl-4-(6-octylsulfanyl-4-thioxo-1H-1,3,5-triazin-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4-[6-(octylthio)-4-sulfanylidene-1H-1,3,5-triazin-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4-(6-octylsulfanyl-4-sulfanylidene-1H-1,3,5-triazin-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-butyl-4-[6-(octylthio)-4-thioxo-1H-s-triazin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C25H39N3OS2 MolecularWeight: 461.72666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NC(=S)NC(=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)N1

Isomeric SMILES

CCCCCCCCSC1=NC(=S)NC(=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)N1

InChI

InChI=1S/C25H39N3OS2/c1-8-9-10-11-12-13-14-31-23-27-21(26-22(30)28-23)17-15-18(24(2,3)4)20(29)19(16-17)25(5,6)7/h15-16H,8-14H2,1-7H3,(H2,26,27,28,30)