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

Systemtic Name: 3-(cyclohexylamino)-1-(2-fluorophenyl)-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 3-(cyclohexylamino)-1-(2-fluorophenyl)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 3-(cyclohexylamino)-1-(2-fluorophenyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 3-(cyclohexylamino)-1-(2-fluorophenyl)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 3-(cyclohexylamino)-1-(2-fluorophenyl)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C22H21FN2O2S MolecularWeight: 396.477743

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C22H21FN2O2S/c23-17-13-7-8-14-18(17)25-21(26)19(24-15-9-3-1-4-10-15)20(22(25)27)28-16-11-5-2-6-12-16/h2,5-8,11-15,24H,1,3-4,9-10H2