3-[cyclohexyl(methyl)amino]-1-(2-fluorophenyl)-4-phenylsulfanyl-pyrrole-2,5-dione

Systemtic Name: 3-[cyclohexyl(methyl)amino]-1-(2-fluorophenyl)-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 3-[cyclohexyl(methyl)amino]-1-(2-fluorophenyl)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 3-[cyclohexyl(methyl)amino]-1-(2-fluorophenyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 3-[cyclohexyl(methyl)amino]-1-(2-fluorophenyl)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 3-[cyclohexyl(methyl)amino]-1-(2-fluorophenyl)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C23H23FN2O2S MolecularWeight: 410.504323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C2=C(C(=O)N(C2=O)C3=CC=CC=C3F)SC4=CC=CC=C4

Isomeric SMILES

CN(C1CCCCC1)C2=C(C(=O)N(C2=O)C3=CC=CC=C3F)SC4=CC=CC=C4

InChI

InChI=1S/C23H23FN2O2S/c1-25(16-10-4-2-5-11-16)20-21(29-17-12-6-3-7-13-17)23(28)26(22(20)27)19-15-9-8-14-18(19)24/h3,6-9,12-16H,2,4-5,10-11H2,1H3