6-azanyl-2-(4-bromophenyl)-5-dimethoxyphosphoryl-4-methylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 6-azanyl-2-(4-bromophenyl)-5-dimethoxyphosphoryl-4-methylsulfanyl-pyridine-3-carbonitrile Openeye Name: 6-amino-2-(4-bromophenyl)-5-dimethoxyphosphoryl-4-methylsulfanyl-pyridine-3-carbonitrile CAS Name: 6-amino-2-(4-bromophenyl)-5-dimethoxyphosphoryl-4-(methylthio)-3-pyridinecarbonitrile IUPAC Name: 6-amino-2-(4-bromophenyl)-5-dimethoxyphosphoryl-4-methylsulfanylpyridine-3-carbonitrile Traditional Name: 6-amino-2-(4-bromophenyl)-5-dimethoxyphosphoryl-4-(methylthio)nicotinonitrile Formula: C15H15BrN3O3PS MolecularWeight: 428.240661

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C1=C(N=C(C(=C1SC)C#N)C2=CC=C(C=C2)Br)N)OC

Isomeric SMILES

COP(=O)(C1=C(N=C(C(=C1SC)C#N)C2=CC=C(C=C2)Br)N)OC

InChI

InChI=1S/C15H15BrN3O3PS/c1-21-23(20,22-2)13-14(24-3)11(8-17)12(19-15(13)18)9-4-6-10(16)7-5-9/h4-7H,1-3H3,(H2,18,19)