3-[2-(4-methylpiperazin-1-yl)-7-oxidanylidene-pteridin-8-yl]propanenitrile

Systemtic Name: 3-[2-(4-methylpiperazin-1-yl)-7-oxidanylidene-pteridin-8-yl]propanenitrile Openeye Name: 3-[2-(4-methylpiperazin-1-yl)-7-oxo-pteridin-8-yl]propanenitrile CAS Name: 3-[2-(4-methyl-1-piperazinyl)-7-oxo-8-pteridinyl]propanenitrile IUPAC Name: 3-[2-(4-methylpiperazin-1-yl)-7-oxopteridin-8-yl]propanenitrile Traditional Name: 3-[7-keto-2-(4-methylpiperazino)pteridin-8-yl]propionitrile Formula: C14H17N7O MolecularWeight: 299.33108

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C3C(=N2)N(C(=O)C=N3)CCC#N

Isomeric SMILES

CN1CCN(CC1)C2=NC=C3C(=N2)N(C(=O)C=N3)CCC#N

InChI

InChI=1S/C14H17N7O/c1-19-5-7-20(8-6-19)14-17-9-11-13(18-14)21(4-2-3-15)12(22)10-16-11/h9-10H,2,4-8H2,1H3