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

Systemtic Name: 2,6-ditert-butyl-4-[[(2-methylphenyl)amino]-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2,6-ditert-butyl-4-[(2-methylanilino)-sulfanyl-methylene]cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4-[mercapto-(2-methylanilino)methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4-[(2-methylanilino)-sulfanylmethylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-butyl-4-[mercapto(o-toluidino)methylene]cyclohexa-2,5-dien-1-one Formula: C22H29NOS MolecularWeight: 355.53676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)S

Isomeric SMILES

CC1=CC=CC=C1NC(=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)S

InChI

InChI=1S/C22H29NOS/c1-14-10-8-9-11-18(14)23-20(25)15-12-16(21(2,3)4)19(24)17(13-15)22(5,6)7/h8-13,23,25H,1-7H3