N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanamide

Systemtic Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanamide Openeye Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-(8-chloro-1,3-dimethyl-2,6-dioxo-purin-7-yl)acetamide CAS Name: N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-(8-chloro-1,3-dimethyl-2,6-dioxo-7-purinyl)acetamide IUPAC Name: N-(5-tert-butyl-2-phenylpyrazol-3-yl)-2-(8-chloro-1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide Traditional Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-(8-chloro-2,6-diketo-1,3-dimethyl-purin-7-yl)acetamide Formula: C22H24ClN7O3 MolecularWeight: 469.92406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CN2C3=C(N=C2Cl)N(C(=O)N(C3=O)C)C)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CN2C3=C(N=C2Cl)N(C(=O)N(C3=O)C)C)C4=CC=CC=C4

InChI

InChI=1S/C22H24ClN7O3/c1-22(2,3)14-11-15(30(26-14)13-9-7-6-8-10-13)24-16(31)12-29-17-18(25-20(29)23)27(4)21(33)28(5)19(17)32/h6-11H,12H2,1-5H3,(H,24,31)