2,6-bis(azanyl)-4-(4-chlorophenyl)-5-diethoxyphosphoryl-4H-thiopyran-3-carbonitrile

Systemtic Name: 2,6-bis(azanyl)-4-(4-chlorophenyl)-5-diethoxyphosphoryl-4H-thiopyran-3-carbonitrile Openeye Name: 2,6-diamino-4-(4-chlorophenyl)-5-diethoxyphosphoryl-4H-thiopyran-3-carbonitrile CAS Name: 2,6-diamino-4-(4-chlorophenyl)-5-diethoxyphosphoryl-4H-thiopyran-3-carbonitrile IUPAC Name: 2,6-diamino-4-(4-chlorophenyl)-5-diethoxyphosphoryl-4H-thiopyran-3-carbonitrile Traditional Name: 2,6-diamino-4-(4-chlorophenyl)-5-diethoxyphosphoryl-4H-thiopyran-3-carbonitrile Formula: C16H19ClN3O3PS MolecularWeight: 399.832121

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(SC(=C(C1C2=CC=C(C=C2)Cl)C#N)N)N)OCC

Isomeric SMILES

CCOP(=O)(C1=C(SC(=C(C1C2=CC=C(C=C2)Cl)C#N)N)N)OCC

InChI

InChI=1S/C16H19ClN3O3PS/c1-3-22-24(21,23-4-2)14-13(10-5-7-11(17)8-6-10)12(9-18)15(19)25-16(14)20/h5-8,13H,3-4,19-20H2,1-2H3