3-(6-methyl-7-oxidanylidene-2-piperazin-1-yl-pteridin-8-yl)propanenitrile

Systemtic Name: 3-(6-methyl-7-oxidanylidene-2-piperazin-1-yl-pteridin-8-yl)propanenitrile Openeye Name: 3-(6-methyl-7-oxo-2-piperazin-1-yl-pteridin-8-yl)propanenitrile CAS Name: 3-[6-methyl-7-oxo-2-(1-piperazinyl)-8-pteridinyl]propanenitrile IUPAC Name: 3-(6-methyl-7-oxo-2-piperazin-1-ylpteridin-8-yl)propanenitrile Traditional Name: 3-(7-keto-6-methyl-2-piperazino-pteridin-8-yl)propionitrile Formula: C14H17N7O MolecularWeight: 299.33108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CN=C(N=C2N(C1=O)CCC#N)N3CCNCC3

Isomeric SMILES

CC1=NC2=CN=C(N=C2N(C1=O)CCC#N)N3CCNCC3

InChI

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