4-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-6-piperidin-1-yl-pyrimidine

Systemtic Name: 4-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-6-piperidin-1-yl-pyrimidine Openeye Name: 4-(4-benzylsulfonylpiperazin-1-yl)-6-(1-piperidyl)pyrimidine CAS Name: 4-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-6-(1-piperidinyl)pyrimidine IUPAC Name: 4-(4-benzylsulfonylpiperazin-1-yl)-6-piperidin-1-ylpyrimidine Traditional Name: 4-(4-benzylsulfonylpiperazino)-6-piperidino-pyrimidine Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C20H27N5O2S/c26-28(27,16-18-7-3-1-4-8-18)25-13-11-24(12-14-25)20-15-19(21-17-22-20)23-9-5-2-6-10-23/h1,3-4,7-8,15,17H,2,5-6,9-14,16H2