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

Systemtic Name: 3-(7-oxidanylidene-6-phenyl-2-piperazin-1-yl-pteridin-8-yl)propanenitrile Openeye Name: 3-(7-oxo-6-phenyl-2-piperazin-1-yl-pteridin-8-yl)propanenitrile CAS Name: 3-[7-oxo-6-phenyl-2-(1-piperazinyl)-8-pteridinyl]propanenitrile IUPAC Name: 3-(7-oxo-6-phenyl-2-piperazin-1-ylpteridin-8-yl)propanenitrile Traditional Name: 3-(7-keto-6-phenyl-2-piperazino-pteridin-8-yl)propionitrile Formula: C19H19N7O MolecularWeight: 361.40046

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=CC=C4)CCC#N

Isomeric SMILES

C1CN(CCN1)C2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=CC=C4)CCC#N

InChI

InChI=1S/C19H19N7O/c20-7-4-10-26-17-15(13-22-19(24-17)25-11-8-21-9-12-25)23-16(18(26)27)14-5-2-1-3-6-14/h1-3,5-6,13,21H,4,8-12H2