3-[diethoxyphosphoryl(1,3-dithian-2-ylidene)methyl]-5-phenyl-1,2-oxazole

Systemtic Name: 3-[diethoxyphosphoryl(1,3-dithian-2-ylidene)methyl]-5-phenyl-1,2-oxazole Openeye Name: 3-[diethoxyphosphoryl(1,3-dithian-2-ylidene)methyl]-5-phenyl-isoxazole CAS Name: 3-[diethoxyphosphoryl(1,3-dithian-2-ylidene)methyl]-5-phenylisoxazole IUPAC Name: 3-[diethoxyphosphoryl(1,3-dithian-2-ylidene)methyl]-5-phenyl-1,2-oxazole Traditional Name: 3-[diethoxyphosphoryl(1,3-dithian-2-ylidene)methyl]-5-phenyl-isoxazole Formula: C18H22NO4PS2 MolecularWeight: 411.475341

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(=C1SCCCS1)C2=NOC(=C2)C3=CC=CC=C3)OCC

Isomeric SMILES

CCOP(=O)(C(=C1SCCCS1)C2=NOC(=C2)C3=CC=CC=C3)OCC

InChI

InChI=1S/C18H22NO4PS2/c1-3-21-24(20,22-4-2)17(18-25-11-8-12-26-18)15-13-16(23-19-15)14-9-6-5-7-10-14/h5-7,9-10,13H,3-4,8,11-12H2,1-2H3