methyl 2-[6-(dimethylaminomethylideneamino)purin-7-yl]pent-4-enoate

Systemtic Name: methyl 2-[6-(dimethylaminomethylideneamino)purin-7-yl]pent-4-enoate Openeye Name: methyl 2-[6-(dimethylaminomethyleneamino)purin-7-yl]pent-4-enoate CAS Name: 2-[6-(dimethylaminomethylideneamino)-7-purinyl]-4-pentenoic acid methyl ester IUPAC Name: methyl 2-[6-(dimethylaminomethylideneamino)purin-7-yl]pent-4-enoate Traditional Name: 2-[6-(dimethylaminomethyleneamino)purin-7-yl]pent-4-enoic acid methyl ester Formula: C14H18N6O2 MolecularWeight: 302.33172

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=NC1=NC=NC2=C1N(C=N2)C(CC=C)C(=O)OC

Isomeric SMILES

CN(C)C=NC1=NC=NC2=C1N(C=N2)C(CC=C)C(=O)OC

InChI

InChI=1S/C14H18N6O2/c1-5-6-10(14(21)22-4)20-9-18-13-11(20)12(15-7-16-13)17-8-19(2)3/h5,7-10H,1,6H2,2-4H3