3,7-dimethyl-8-[(2E)-2-[(4-propan-2-ylphenyl)methylidene]hydrazinyl]purine-2,6-dione

Systemtic Name: 3,7-dimethyl-8-[(2E)-2-[(4-propan-2-ylphenyl)methylidene]hydrazinyl]purine-2,6-dione Openeye Name: 8-[(2E)-2-[(4-isopropylphenyl)methylene]hydrazino]-3,7-dimethyl-purine-2,6-dione CAS Name: 3,7-dimethyl-8-[(2E)-2-[(4-propan-2-ylphenyl)methylidene]hydrazinyl]purine-2,6-dione IUPAC Name: 3,7-dimethyl-8-[(2E)-2-[(4-propan-2-ylphenyl)methylidene]hydrazinyl]purine-2,6-dione Traditional Name: 8-[(N'E)-N'-(4-isopropylbenzylidene)hydrazino]-3,7-dimethyl-xanthine Formula: C17H20N6O2 MolecularWeight: 340.3797

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=NNC2=NC3=C(N2C)C(=O)NC(=O)N3C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=N/NC2=NC3=C(N2C)C(=O)NC(=O)N3C

InChI

InChI=1S/C17H20N6O2/c1-10(2)12-7-5-11(6-8-12)9-18-21-16-19-14-13(22(16)3)15(24)20-17(25)23(14)4/h5-10H,1-4H3,(H,19,21)(H,20,24,25)/b18-9+