[[2,7-bis(fluoranyl)-10-methyl-acridin-9-ylidene]-phenylsulfanyl-methyl] bis(3-cyanopropyl) phosphate

Systemtic Name: [[2,7-bis(fluoranyl)-10-methyl-acridin-9-ylidene]-phenylsulfanyl-methyl] bis(3-cyanopropyl) phosphate Openeye Name: bis(3-cyanopropyl) [(2,7-difluoro-10-methyl-acridin-9-ylidene)-phenylsulfanyl-methyl] phosphate CAS Name: phosphoric acid bis(3-cyanopropyl) [(2,7-difluoro-10-methyl-9-acridinylidene)-(phenylthio)methyl] ester IUPAC Name: bis(3-cyanopropyl) [(2,7-difluoro-10-methylacridin-9-ylidene)-phenylsulfanylmethyl] phosphate Traditional Name: phosphoric acid bis(3-cyanopropyl) [(2,7-difluoro-10-methyl-acridin-9-ylidene)-(phenylthio)methyl] ester Formula: C29H26F2N3O4PS MolecularWeight: 581.570007

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)F)C(=C(OP(=O)(OCCCC#N)OCCCC#N)SC3=CC=CC=C3)C4=C1C=CC(=C4)F

Isomeric SMILES

CN1C2=C(C=C(C=C2)F)C(=C(OP(=O)(OCCCC#N)OCCCC#N)SC3=CC=CC=C3)C4=C1C=CC(=C4)F

InChI

InChI=1S/C29H26F2N3O4PS/c1-34-26-13-11-21(30)19-24(26)28(25-20-22(31)12-14-27(25)34)29(40-23-9-3-2-4-10-23)38-39(35,36-17-7-5-15-32)37-18-8-6-16-33/h2-4,9-14,19-20H,5-8,17-18H2,1H3