2-[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)pyrimidin-2-yl]sulfanyl-1-phenyl-ethanone

Systemtic Name: 2-[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)pyrimidin-2-yl]sulfanyl-1-phenyl-ethanone Openeye Name: 2-[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)pyrimidin-2-yl]sulfanyl-1-phenyl-ethanone CAS Name: 2-[[4-(2,7-dimethyl-6-pyrazolo[1,5-a]pyrimidinyl)-2-pyrimidinyl]thio]-1-phenylethanone IUPAC Name: 2-[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)pyrimidin-2-yl]sulfanyl-1-phenylethanone Traditional Name: 2-[[4-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)pyrimidin-2-yl]thio]-1-phenyl-ethanone Formula: C20H17N5OS MolecularWeight: 375.44688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=C(C=NC2=C1)C3=NC(=NC=C3)SCC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=NN2C(=C(C=NC2=C1)C3=NC(=NC=C3)SCC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C20H17N5OS/c1-13-10-19-22-11-16(14(2)25(19)24-13)17-8-9-21-20(23-17)27-12-18(26)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3