[5-cyano-3-[ethoxy(phenyl)phosphoryl]-4-methylsulfanyl-6-phenyl-pyran-2-ylidene]azanium

Systemtic Name: [5-cyano-3-[ethoxy(phenyl)phosphoryl]-4-methylsulfanyl-6-phenyl-pyran-2-ylidene]azanium Openeye Name: [5-cyano-3-[ethoxy(phenyl)phosphoryl]-4-methylsulfanyl-6-phenyl-pyran-2-ylidene]ammonium CAS Name: [5-cyano-3-[ethoxy(phenyl)phosphoryl]-4-(methylthio)-6-phenyl-2-pyranylidene]ammonium IUPAC Name: [5-cyano-3-[ethoxy(phenyl)phosphoryl]-4-methylsulfanyl-6-phenylpyran-2-ylidene]azanium Traditional Name: [5-cyano-3-[ethoxy(phenyl)phosphoryl]-4-(methylthio)-6-phenyl-pyran-2-ylidene]ammonium Formula: C21H20N2O3PS+ MolecularWeight: 411.433861

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC=CC=C1)C2=C(C(=C(OC2=[NH2+])C3=CC=CC=C3)C#N)SC

Isomeric SMILES

CCOP(=O)(C1=CC=CC=C1)C2=C(C(=C(OC2=[NH2+])C3=CC=CC=C3)C#N)SC

InChI

InChI=1S/C21H19N2O3PS/c1-3-25-27(24,16-12-8-5-9-13-16)19-20(28-2)17(14-22)18(26-21(19)23)15-10-6-4-7-11-15/h4-13,23H,3H2,1-2H3/p+1