bis(2-cyanoethyl) [(10-methylacridin-9-ylidene)-phenylsulfanyl-methyl] phosphate

Systemtic Name: bis(2-cyanoethyl) [(10-methylacridin-9-ylidene)-phenylsulfanyl-methyl] phosphate Openeye Name: bis(2-cyanoethyl) [(10-methylacridin-9-ylidene)-phenylsulfanyl-methyl] phosphate CAS Name: phosphoric acid bis(2-cyanoethyl) [(10-methyl-9-acridinylidene)-(phenylthio)methyl] ester IUPAC Name: bis(2-cyanoethyl) [(10-methylacridin-9-ylidene)-phenylsulfanylmethyl] phosphate Traditional Name: phosphoric acid bis(2-cyanoethyl) [(10-methylacridin-9-ylidene)-(phenylthio)methyl] ester Formula: C27H24N3O4PS MolecularWeight: 517.535921

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(OP(=O)(OCCC#N)OCCC#N)SC3=CC=CC=C3)C4=CC=CC=C41

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(OP(=O)(OCCC#N)OCCC#N)SC3=CC=CC=C3)C4=CC=CC=C41

InChI

InChI=1S/C27H24N3O4PS/c1-30-24-15-7-5-13-22(24)26(23-14-6-8-16-25(23)30)27(36-21-11-3-2-4-12-21)34-35(31,32-19-9-17-28)33-20-10-18-29/h2-8,11-16H,9-10,19-20H2,1H3