2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(5-methyl-2-phenyl-pyrazol-3-yl)ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(5-methyl-2-phenyl-3-pyrazolyl)acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(5-methyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(5-methyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C19H19N7O3 MolecularWeight: 393.39926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CN2C=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=CC=C4

InChI

InChI=1S/C19H19N7O3/c1-12-9-14(26(22-12)13-7-5-4-6-8-13)21-15(27)10-25-11-20-17-16(25)18(28)24(3)19(29)23(17)2/h4-9,11H,10H2,1-3H3,(H,21,27)