3-[8-[(E)-diazanylidenemethyl]-3-methyl-2,6-bis(oxidanylidene)purin-7-yl]propanenitrile

Systemtic Name: 3-[8-[(E)-diazanylidenemethyl]-3-methyl-2,6-bis(oxidanylidene)purin-7-yl]propanenitrile Openeye Name: 3-[8-[(E)-hydrazinylidenemethyl]-3-methyl-2,6-dioxo-purin-7-yl]propanenitrile CAS Name: 3-[8-[(E)-hydrazinylidenemethyl]-3-methyl-2,6-dioxo-7-purinyl]propanenitrile IUPAC Name: 3-[8-[(E)-hydrazinylidenemethyl]-3-methyl-2,6-dioxopurin-7-yl]propanenitrile Traditional Name: 3-[8-[(E)-hydrazonomethyl]-2,6-diketo-3-methyl-purin-7-yl]propionitrile Formula: C10H11N7O2 MolecularWeight: 261.24004

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)C=NN)CCC#N

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)/C=N/N)CCC#N

InChI

InChI=1S/C10H11N7O2/c1-16-8-7(9(18)15-10(16)19)17(4-2-3-11)6(14-8)5-13-12/h5H,2,4,12H2,1H3,(H,15,18,19)/b13-5+