5-bromanyl-2-piperazin-1-yl-6-thiomorpholin-4-yl-pyrimidine-4-carbonitrile

Systemtic Name: 5-bromanyl-2-piperazin-1-yl-6-thiomorpholin-4-yl-pyrimidine-4-carbonitrile Openeye Name: 5-bromo-2-piperazin-1-yl-6-thiomorpholino-pyrimidine-4-carbonitrile CAS Name: 5-bromo-2-(1-piperazinyl)-6-thiomorpholin-4-yl-4-pyrimidinecarbonitrile IUPAC Name: 5-bromo-2-piperazin-1-yl-6-thiomorpholin-4-ylpyrimidine-4-carbonitrile Traditional Name: 5-bromo-2-piperazino-6-thiomorpholino-pyrimidine-4-carbonitrile Formula: C13H17BrN6S MolecularWeight: 369.28328

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC(=C(C(=N2)N3CCSCC3)Br)C#N

Isomeric SMILES

C1CN(CCN1)C2=NC(=C(C(=N2)N3CCSCC3)Br)C#N

InChI

InChI=1S/C13H17BrN6S/c14-11-10(9-15)17-13(20-3-1-16-2-4-20)18-12(11)19-5-7-21-8-6-19/h16H,1-8H2