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

Systemtic Name: 3-[(4-chloranyl-2-oxidanyl-phenyl)amino]-4-(thiolan-3-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-(4-chloro-2-hydroxy-anilino)-4-(tetrahydrothiophen-3-ylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(4-chloro-2-hydroxyanilino)-4-(3-thiolanylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(4-chloro-2-hydroxyanilino)-4-(thiolan-3-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(4-chloro-2-hydroxy-anilino)-4-(tetrahydrothiophen-3-ylamino)cyclobut-3-ene-1,2-quinone Formula: C14H13ClN2O3S MolecularWeight: 324.78262

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC1NC2=C(C(=O)C2=O)NC3=C(C=C(C=C3)Cl)O

Isomeric SMILES

C1CSCC1NC2=C(C(=O)C2=O)NC3=C(C=C(C=C3)Cl)O

InChI

InChI=1S/C14H13ClN2O3S/c15-7-1-2-9(10(18)5-7)17-12-11(13(19)14(12)20)16-8-3-4-21-6-8/h1-2,5,8,16-18H,3-4,6H2