1,3,7-trimethyl-8-[(2E)-2-[(4-propan-2-ylphenyl)methylidene]hydrazinyl]purine-2,6-dione

Systemtic Name: 1,3,7-trimethyl-8-[(2E)-2-[(4-propan-2-ylphenyl)methylidene]hydrazinyl]purine-2,6-dione Openeye Name: 8-[(2E)-2-[(4-isopropylphenyl)methylene]hydrazino]-1,3,7-trimethyl-purine-2,6-dione CAS Name: 1,3,7-trimethyl-8-[(2E)-2-[(4-propan-2-ylphenyl)methylidene]hydrazinyl]purine-2,6-dione IUPAC Name: 1,3,7-trimethyl-8-[(2E)-2-[(4-propan-2-ylphenyl)methylidene]hydrazinyl]purine-2,6-dione Traditional Name: 8-[(N'E)-N'-(4-isopropylbenzylidene)hydrazino]-1,3,7-trimethyl-xanthine Formula: C18H22N6O2 MolecularWeight: 354.40628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N6O2/c1-11(2)13-8-6-12(7-9-13)10-19-21-17-20-15-14(22(17)3)16(25)24(5)18(26)23(15)4/h6-11H,1-5H3,(H,20,21)/b19-10+