2,6-ditert-butyl-4-[5-(4-methylphenyl)sulfonyl-1,2,4-thiadiazol-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-ditert-butyl-4-[5-(4-methylphenyl)sulfonyl-1,2,4-thiadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2,6-ditert-butyl-4-[5-(p-tolylsulfonyl)-1,2,4-thiadiazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4-[5-(4-methylphenyl)sulfonyl-1,2,4-thiadiazol-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4-[5-(4-methylphenyl)sulfonyl-1,2,4-thiadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-butyl-4-(5-tosyl-1,2,4-thiadiazol-3-ylidene)cyclohexa-2,5-dien-1-one Formula: C23H28N2O3S2 MolecularWeight: 444.61002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=NC(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)NS2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=NC(=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)NS2

InChI

InChI=1S/C23H28N2O3S2/c1-14-8-10-16(11-9-14)30(27,28)21-24-20(25-29-21)15-12-17(22(2,3)4)19(26)18(13-15)23(5,6)7/h8-13,25H,1-7H3