(E)-1-(9H-fluoren-3-yl)-3-(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(9H-fluoren-3-yl)-3-(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(9H-fluoren-3-yl)-3-(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)prop-2-en-1-one CAS Name: (E)-1-(9H-fluoren-3-yl)-3-[3-nitro-4-(2-pyrimidinylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(9H-fluoren-3-yl)-3-(3-nitro-4-pyrimidin-2-ylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(9H-fluoren-3-yl)-3-[3-nitro-4-(2-pyrimidylthio)phenyl]prop-2-en-1-one Formula: C26H17N3O3S MolecularWeight: 451.49648

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)C(=O)C=CC3=CC(=C(C=C3)SC4=NC=CC=N4)[N+](=O)[O-])C5=CC=CC=C51

Isomeric SMILES

C1C2=C(C=C(C=C2)C(=O)/C=C/C3=CC(=C(C=C3)SC4=NC=CC=N4)[N+](=O)[O-])C5=CC=CC=C51

InChI

InChI=1S/C26H17N3O3S/c30-24(20-9-8-19-15-18-4-1-2-5-21(18)22(19)16-20)10-6-17-7-11-25(23(14-17)29(31)32)33-26-27-12-3-13-28-26/h1-14,16H,15H2/b10-6+