N-[4-(1,3-dimethyl-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-6-yl)phenyl]-2-phenoxy-ethanamide

Systemtic Name: N-[4-(1,3-dimethyl-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-6-yl)phenyl]-2-phenoxy-ethanamide Openeye Name: N-[4-(1,3-dimethyl-7-oxo-pyrazolo[4,3-d]pyrimidin-6-yl)phenyl]-2-phenoxy-acetamide CAS Name: N-[4-(1,3-dimethyl-7-oxo-6-pyrazolo[4,3-d]pyrimidinyl)phenyl]-2-phenoxyacetamide IUPAC Name: N-[4-(1,3-dimethyl-7-oxopyrazolo[4,3-d]pyrimidin-6-yl)phenyl]-2-phenoxyacetamide Traditional Name: N-[4-(7-keto-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-6-yl)phenyl]-2-phenoxy-acetamide Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=CN(C2=O)C3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C2=C1N=CN(C2=O)C3=CC=C(C=C3)NC(=O)COC4=CC=CC=C4)C

InChI

InChI=1S/C21H19N5O3/c1-14-19-20(25(2)24-14)21(28)26(13-22-19)16-10-8-15(9-11-16)23-18(27)12-29-17-6-4-3-5-7-17/h3-11,13H,12H2,1-2H3,(H,23,27)