1-[4-(1,3-dimethylpyrazolo[4,3-d]pyrimidin-7-yl)piperazin-1-yl]-4-phenyl-butan-1-one

Systemtic Name: 1-[4-(1,3-dimethylpyrazolo[4,3-d]pyrimidin-7-yl)piperazin-1-yl]-4-phenyl-butan-1-one Openeye Name: 1-[4-(1,3-dimethylpyrazolo[4,3-d]pyrimidin-7-yl)piperazin-1-yl]-4-phenyl-butan-1-one CAS Name: 1-[4-(1,3-dimethyl-7-pyrazolo[4,3-d]pyrimidinyl)-1-piperazinyl]-4-phenyl-1-butanone IUPAC Name: 1-[4-(1,3-dimethylpyrazolo[4,3-d]pyrimidin-7-yl)piperazin-1-yl]-4-phenylbutan-1-one Traditional Name: 1-[4-(1,3-dimethylpyrazolo[4,3-d]pyrimidin-7-yl)piperazino]-4-phenyl-butan-1-one Formula: C21H26N6O MolecularWeight: 378.47074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=CN=C2N3CCN(CC3)C(=O)CCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C2=C1N=CN=C2N3CCN(CC3)C(=O)CCCC4=CC=CC=C4)C

InChI

InChI=1S/C21H26N6O/c1-16-19-20(25(2)24-16)21(23-15-22-19)27-13-11-26(12-14-27)18(28)10-6-9-17-7-4-3-5-8-17/h3-5,7-8,15H,6,9-14H2,1-2H3