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

Systemtic Name: 2-[2-cyclohexyl-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-4-(phenylmethyl)-3-sulfanylidene-piperazin-1-yl]-2-oxidanylidene-ethanethial Openeye Name: 2-[4-benzyl-2-cyclohexyl-2-(3,5-ditert-butyl-4-hydroxy-phenyl)-3-thioxo-piperazin-1-yl]-2-oxo-ethanethial CAS Name: 2-[2-cyclohexyl-2-(3,5-ditert-butyl-4-hydroxyphenyl)-4-(phenylmethyl)-3-sulfanylidene-1-piperazinyl]-2-oxoethanethial IUPAC Name: 2-[4-benzyl-2-cyclohexyl-2-(3,5-ditert-butyl-4-hydroxyphenyl)-3-sulfanylidenepiperazin-1-yl]-2-oxoethanethial Traditional Name: 2-[4-benzyl-2-cyclohexyl-2-(3,5-ditert-butyl-4-hydroxy-phenyl)-3-thioxo-piperazino]-2-keto-thioacetaldehyde Formula: C33H44N2O2S2 MolecularWeight: 564.84466

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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)CC3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2(C(=S)N(CCN2C(=O)C=S)CC3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C33H44N2O2S2/c1-31(2,3)26-19-25(20-27(29(26)37)32(4,5)6)33(24-15-11-8-12-16-24)30(39)34(17-18-35(33)28(36)22-38)21-23-13-9-7-10-14-23/h7,9-10,13-14,19-20,22,24,37H,8,11-12,15-18,21H2,1-6H3