3-methyl-7-phenethyl-8-(2-propan-2-ylidenehydrazinyl)purine-2,6-dione

Systemtic Name: 3-methyl-7-phenethyl-8-(2-propan-2-ylidenehydrazinyl)purine-2,6-dione Openeye Name: 8-(2-isopropylidenehydrazino)-3-methyl-7-phenethyl-purine-2,6-dione CAS Name: 3-methyl-7-phenethyl-8-(2-propan-2-ylidenehydrazinyl)purine-2,6-dione IUPAC Name: 3-methyl-7-phenethyl-8-(2-propan-2-ylidenehydrazinyl)purine-2,6-dione Traditional Name: 8-(N'-isopropylidenehydrazino)-3-methyl-7-phenethyl-xanthine Formula: C17H20N6O2 MolecularWeight: 340.3797

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC2=C(N1CCC3=CC=CC=C3)C(=O)NC(=O)N2C)C

Isomeric SMILES

CC(=NNC1=NC2=C(N1CCC3=CC=CC=C3)C(=O)NC(=O)N2C)C

InChI

InChI=1S/C17H20N6O2/c1-11(2)20-21-16-18-14-13(15(24)19-17(25)22(14)3)23(16)10-9-12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3,(H,18,21)(H,19,24,25)