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3-(7-oxidanylidene-6-phenethyl-2-phenylazanyl-pteridin-8-yl)propanenitrile

3-(7-oxidanylidene-6-phenethyl-2-phenylazanyl-pteridin-8-yl)propanenitrile

Systemtic Name:3-(7-oxidanylidene-6-phenethyl-2-phenylazanyl-pteridin-8-yl)propanenitrile
Openeye Name:3-(2-anilino-7-oxo-6-phenethyl-pteridin-8-yl)propanenitrile
CAS Name:3-(2-anilino-7-oxo-6-phenethyl-8-pteridinyl)propanenitrile
IUPAC Name:3-(2-anilino-7-oxo-6-phenethylpteridin-8-yl)propanenitrile
Traditional Name:3-(2-anilino-7-keto-6-phenethyl-pteridin-8-yl)propionitrile
Formula: C23H20N6O
MolecularWeight: 396.4445
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NC3=CN=C(N=C3N(C2=O)CCC#N)NC4=CC=CC=C4


Isomeric SMILES

C1=CC=C(C=C1)CCC2=NC3=CN=C(N=C3N(C2=O)CCC#N)NC4=CC=CC=C4


InChI

InChI=1S/C23H20N6O/c24-14-7-15-29-21-20(16-25-23(28-21)26-18-10-5-2-6-11-18)27-19(22(29)30)13-12-17-8-3-1-4-9-17/h1-6,8-11,16H,7,12-13,15H2,(H,25,26,28)


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