4-[[(4-aminophenyl)amino]-sulfanyl-methylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[(4-aminophenyl)amino]-sulfanyl-methylidene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[(4-aminoanilino)-sulfanyl-methylene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one CAS Name: 4-[(4-aminoanilino)-mercaptomethylidene]-2,6-ditert-butyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(4-aminoanilino)-sulfanylmethylidene]-2,6-ditert-butylcyclohexa-2,5-dien-1-one Traditional Name: 4-[(4-aminoanilino)-mercapto-methylene]-2,6-ditert-butyl-cyclohexa-2,5-dien-1-one Formula: C21H28N2OS MolecularWeight: 356.52482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(NC2=CC=C(C=C2)N)S)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(NC2=CC=C(C=C2)N)S)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C21H28N2OS/c1-20(2,3)16-11-13(12-17(18(16)24)21(4,5)6)19(25)23-15-9-7-14(22)8-10-15/h7-12,23,25H,22H2,1-6H3