(3Z,5E)-1-(2-diethoxyphosphorylethyl)-3,5-bis(thiophen-2-ylmethylidene)piperidin-4-one

Systemtic Name: (3Z,5E)-1-(2-diethoxyphosphorylethyl)-3,5-bis(thiophen-2-ylmethylidene)piperidin-4-one Openeye Name: (3Z,5E)-1-(2-diethoxyphosphorylethyl)-3,5-bis(2-thienylmethylene)piperidin-4-one CAS Name: (3Z,5E)-1-(2-diethoxyphosphorylethyl)-3,5-bis(thiophen-2-ylmethylidene)-4-piperidinone IUPAC Name: (3Z,5E)-1-(2-diethoxyphosphorylethyl)-3,5-bis(thiophen-2-ylmethylidene)piperidin-4-one Traditional Name: (3Z,5E)-1-(2-diethoxyphosphorylethyl)-3,5-bis(2-thenylidene)-4-piperidone Formula: C21H26NO4PS2 MolecularWeight: 451.539201

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCN1CC(=CC2=CC=CS2)C(=O)C(=CC3=CC=CS3)C1)OCC

Isomeric SMILES

CCOP(=O)(CCN1C/C(=C\C2=CC=CS2)/C(=O)/C(=C\C3=CC=CS3)/C1)OCC

InChI

InChI=1S/C21H26NO4PS2/c1-3-25-27(24,26-4-2)10-9-22-15-17(13-19-7-5-11-28-19)21(23)18(16-22)14-20-8-6-12-29-20/h5-8,11-14H,3-4,9-10,15-16H2,1-2H3/b17-13-,18-14+