3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(2-fluorophenyl)pyrrole-2,5-dione

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(2-fluorophenyl)pyrrole-2,5-dione Openeye Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(2-fluorophenyl)pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-4-(cyclohexylamino)-1-(2-fluorophenyl)pyrrole-2,5-dione IUPAC Name: 3-(4-chlorophenyl)sulfanyl-4-(cyclohexylamino)-1-(2-fluorophenyl)pyrrole-2,5-dione Traditional Name: 3-[(4-chlorophenyl)thio]-4-(cyclohexylamino)-1-(2-fluorophenyl)-3-pyrroline-2,5-quinone Formula: C22H20ClFN2O2S MolecularWeight: 430.922803

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C(C(=O)N(C2=O)C3=CC=CC=C3F)SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)NC2=C(C(=O)N(C2=O)C3=CC=CC=C3F)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClFN2O2S/c23-14-10-12-16(13-11-14)29-20-19(25-15-6-2-1-3-7-15)21(27)26(22(20)28)18-9-5-4-8-17(18)24/h4-5,8-13,15,25H,1-3,6-7H2