3,7-dimethyl-8-[2-(2-oxidanylideneindol-3-yl)hydrazinyl]-1-prop-2-enyl-purine-2,6-dione

Systemtic Name: 3,7-dimethyl-8-[2-(2-oxidanylideneindol-3-yl)hydrazinyl]-1-prop-2-enyl-purine-2,6-dione Openeye Name: 1-allyl-3,7-dimethyl-8-[2-(2-oxoindol-3-yl)hydrazino]purine-2,6-dione CAS Name: 3,7-dimethyl-8-[(2-oxo-3-indolyl)hydrazo]-1-prop-2-enylpurine-2,6-dione IUPAC Name: 3,7-dimethyl-8-[2-(2-oxoindol-3-yl)hydrazinyl]-1-prop-2-enylpurine-2,6-dione Traditional Name: 1-allyl-8-[N'-(2-ketoindol-3-yl)hydrazino]-3,7-dimethyl-xanthine Formula: C18H17N7O3 MolecularWeight: 379.37268

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NNC3=C4C=CC=CC4=NC3=O)N(C(=O)N(C2=O)CC=C)C

Isomeric SMILES

CN1C2=C(N=C1NNC3=C4C=CC=CC4=NC3=O)N(C(=O)N(C2=O)CC=C)C

InChI

InChI=1S/C18H17N7O3/c1-4-9-25-16(27)13-14(24(3)18(25)28)20-17(23(13)2)22-21-12-10-7-5-6-8-11(10)19-15(12)26/h4-8H,1,9H2,2-3H3,(H,20,22)(H,19,21,26)