2-(4-piperazin-1-yl-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidin-2-yl)ethanenitrile

Systemtic Name: 2-(4-piperazin-1-yl-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidin-2-yl)ethanenitrile Openeye Name: 2-(4-piperazin-1-yl-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidin-2-yl)acetonitrile CAS Name: 2-[4-(1-piperazinyl)-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidin-2-yl]acetonitrile IUPAC Name: 2-(4-piperazin-1-yl-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidin-2-yl)acetonitrile Traditional Name: 2-(4-piperazino-7,8-dihydro-6H-thiopyrano[3,2-d]pyrimidin-2-yl)acetonitrile Formula: C13H17N5S MolecularWeight: 275.37258

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=NC(=N2)CC#N)N3CCNCC3)SC1

Isomeric SMILES

C1CC2=C(C(=NC(=N2)CC#N)N3CCNCC3)SC1

InChI

InChI=1S/C13H17N5S/c14-4-3-11-16-10-2-1-9-19-12(10)13(17-11)18-7-5-15-6-8-18/h15H,1-3,5-9H2