1,3-dimethyl-7-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-5-propan-2-yl-pyrazolo[4,3-d]pyrimidine

Systemtic Name: 1,3-dimethyl-7-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-5-propan-2-yl-pyrazolo[4,3-d]pyrimidine Openeye Name: 7-(4-benzylsulfonylpiperazin-1-yl)-5-isopropyl-1,3-dimethyl-pyrazolo[4,3-d]pyrimidine CAS Name: 1,3-dimethyl-7-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-5-propan-2-ylpyrazolo[4,3-d]pyrimidine IUPAC Name: 7-(4-benzylsulfonylpiperazin-1-yl)-1,3-dimethyl-5-propan-2-ylpyrazolo[4,3-d]pyrimidine Traditional Name: 7-(4-benzylsulfonylpiperazino)-5-isopropyl-1,3-dimethyl-pyrazolo[4,3-d]pyrimidine Formula: C21H28N6O2S MolecularWeight: 428.55102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(N=C2N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C(C)C)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N=C2N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C(C)C)C

InChI

InChI=1S/C21H28N6O2S/c1-15(2)20-22-18-16(3)24-25(4)19(18)21(23-20)26-10-12-27(13-11-26)30(28,29)14-17-8-6-5-7-9-17/h5-9,15H,10-14H2,1-4H3