3-(4-methylphenyl)-4-[(3-methylsulfanylphenyl)amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(4-methylphenyl)-4-[(3-methylsulfanylphenyl)amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(3-methylsulfanylanilino)-4-(p-tolyl)cyclobut-3-ene-1,2-dione CAS Name: 3-(4-methylphenyl)-4-[3-(methylthio)anilino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(4-methylphenyl)-4-(3-methylsulfanylanilino)cyclobut-3-ene-1,2-dione Traditional Name: 3-[3-(methylthio)anilino]-4-(p-tolyl)cyclobut-3-ene-1,2-quinone Formula: C18H15NO2S MolecularWeight: 309.3822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C2=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C2=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C18H15NO2S/c1-11-6-8-12(9-7-11)15-16(18(21)17(15)20)19-13-4-3-5-14(10-13)22-2/h3-10,19H,1-2H3