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

Systemtic Name: 3-[(3-methylsulfanylphenyl)amino]-4-phenyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-(3-methylsulfanylanilino)-4-phenyl-cyclobut-3-ene-1,2-dione CAS Name: 3-[3-(methylthio)anilino]-4-phenylcyclobut-3-ene-1,2-dione IUPAC Name: 3-(3-methylsulfanylanilino)-4-phenylcyclobut-3-ene-1,2-dione Traditional Name: 3-[3-(methylthio)anilino]-4-phenyl-cyclobut-3-ene-1,2-quinone Formula: C17H13NO2S MolecularWeight: 295.35562

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC2=C(C(=O)C2=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC(=C1)NC2=C(C(=O)C2=O)C3=CC=CC=C3

InChI

InChI=1S/C17H13NO2S/c1-21-13-9-5-8-12(10-13)18-15-14(16(19)17(15)20)11-6-3-2-4-7-11/h2-10,18H,1H3