4-[4-(phenylsulfonyl)piperazin-1-yl]-6-pyrrolidin-1-yl-pyrimidine

Systemtic Name: 4-[4-(phenylsulfonyl)piperazin-1-yl]-6-pyrrolidin-1-yl-pyrimidine Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-6-pyrrolidin-1-yl-pyrimidine CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-6-(1-pyrrolidinyl)pyrimidine IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-6-pyrrolidin-1-ylpyrimidine Traditional Name: 4-(4-besylpiperazino)-6-pyrrolidino-pyrimidine Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC=N2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=CC(=NC=N2)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C18H23N5O2S/c24-26(25,16-6-2-1-3-7-16)23-12-10-22(11-13-23)18-14-17(19-15-20-18)21-8-4-5-9-21/h1-3,6-7,14-15H,4-5,8-13H2