2-[2-cyclohexyl-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-4-methyl-3-sulfanylidene-piperazin-1-yl]-2-oxidanylidene-ethanethial

Systemtic Name: 2-[2-cyclohexyl-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-4-methyl-3-sulfanylidene-piperazin-1-yl]-2-oxidanylidene-ethanethial Openeye Name: 2-[2-cyclohexyl-2-(3,5-ditert-butyl-4-hydroxy-phenyl)-4-methyl-3-thioxo-piperazin-1-yl]-2-oxo-ethanethial CAS Name: 2-[2-cyclohexyl-2-(3,5-ditert-butyl-4-hydroxyphenyl)-4-methyl-3-sulfanylidene-1-piperazinyl]-2-oxoethanethial IUPAC Name: 2-[2-cyclohexyl-2-(3,5-ditert-butyl-4-hydroxyphenyl)-4-methyl-3-sulfanylidenepiperazin-1-yl]-2-oxoethanethial Traditional Name: 2-[2-cyclohexyl-2-(3,5-ditert-butyl-4-hydroxy-phenyl)-4-methyl-3-thioxo-piperazino]-2-keto-thioacetaldehyde Formula: C27H40N2O2S2 MolecularWeight: 488.7487

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2(C(=S)N(CCN2C(=O)C=S)C)C3CCCCC3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2(C(=S)N(CCN2C(=O)C=S)C)C3CCCCC3

InChI

InChI=1S/C27H40N2O2S2/c1-25(2,3)20-15-19(16-21(23(20)31)26(4,5)6)27(18-11-9-8-10-12-18)24(33)28(7)13-14-29(27)22(30)17-32/h15-18,31H,8-14H2,1-7H3