3-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]pteridin-4-one

Systemtic Name: 3-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]pteridin-4-one Openeye Name: 3-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]pteridin-4-one CAS Name: 3-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]-4-pteridinone IUPAC Name: 3-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]pteridin-4-one Traditional Name: 3-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl]pteridin-4-one Formula: C16H11ClN6O MolecularWeight: 338.75114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C=NN2)CN3C=NC4=NC=CN=C4C3=O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=NN2)CN3C=NC4=NC=CN=C4C3=O)Cl

InChI

InChI=1S/C16H11ClN6O/c17-12-3-1-10(2-4-12)13-11(7-21-22-13)8-23-9-20-15-14(16(23)24)18-5-6-19-15/h1-7,9H,8H2,(H,21,22)