3-[(4-chloranyl-3-methylsulfonyl-2-oxidanyl-phenyl)amino]-4-(thiolan-3-ylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(4-chloranyl-3-methylsulfonyl-2-oxidanyl-phenyl)amino]-4-(thiolan-3-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-(4-chloro-2-hydroxy-3-methylsulfonyl-anilino)-4-(tetrahydrothiophen-3-ylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(4-chloro-2-hydroxy-3-methylsulfonylanilino)-4-(3-thiolanylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(4-chloro-2-hydroxy-3-methylsulfonylanilino)-4-(thiolan-3-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(4-chloro-2-hydroxy-3-mesyl-anilino)-4-(tetrahydrothiophen-3-ylamino)cyclobut-3-ene-1,2-quinone Formula: C15H15ClN2O5S2 MolecularWeight: 402.873

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1O)NC2=C(C(=O)C2=O)NC3CCSC3)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1O)NC2=C(C(=O)C2=O)NC3CCSC3)Cl

InChI

InChI=1S/C15H15ClN2O5S2/c1-25(22,23)15-8(16)2-3-9(12(15)19)18-11-10(13(20)14(11)21)17-7-4-5-24-6-7/h2-3,7,17-19H,4-6H2,1H3