7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-[(E)-4-phenylbut-3-en-2-ylidene]hydrazinyl]purine-2,6-dione

Systemtic Name: 7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-[(E)-4-phenylbut-3-en-2-ylidene]hydrazinyl]purine-2,6-dione Openeye Name: 7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-[(E)-1-methyl-3-phenyl-prop-2-enylidene]hydrazino]purine-2,6-dione CAS Name: 7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-[(E)-4-phenylbut-3-en-2-ylidene]hydrazinyl]purine-2,6-dione IUPAC Name: 7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-[(E)-4-phenylbut-3-en-2-ylidene]hydrazinyl]purine-2,6-dione Traditional Name: 7-(2-hydroxyethyl)-3-methyl-8-[(N'E)-N'-[(E)-1-methyl-3-phenyl-prop-2-enylidene]hydrazino]xanthine Formula: C18H20N6O3 MolecularWeight: 368.3898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=NC2=C(N1CCO)C(=O)NC(=O)N2C)C=CC3=CC=CC=C3

Isomeric SMILES

C/C(=N\NC1=NC2=C(N1CCO)C(=O)NC(=O)N2C)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C18H20N6O3/c1-12(8-9-13-6-4-3-5-7-13)21-22-17-19-15-14(24(17)10-11-25)16(26)20-18(27)23(15)2/h3-9,25H,10-11H2,1-2H3,(H,19,22)(H,20,26,27)/b9-8+,21-12+