2-[4-[[3-(oxolan-2-ylmethyl)-2-propylsulfonyl-imidazol-4-yl]methyl]piperazin-1-yl]pyrimidine

Systemtic Name: 2-[4-[[3-(oxolan-2-ylmethyl)-2-propylsulfonyl-imidazol-4-yl]methyl]piperazin-1-yl]pyrimidine Openeye Name: 2-[4-[[2-propylsulfonyl-3-(tetrahydrofuran-2-ylmethyl)imidazol-4-yl]methyl]piperazin-1-yl]pyrimidine CAS Name: 2-[4-[[3-(2-oxolanylmethyl)-2-propylsulfonyl-4-imidazolyl]methyl]-1-piperazinyl]pyrimidine IUPAC Name: 2-[4-[[3-(oxolan-2-ylmethyl)-2-propylsulfonylimidazol-4-yl]methyl]piperazin-1-yl]pyrimidine Traditional Name: 2-[4-[[2-propylsulfonyl-3-(tetrahydrofurfuryl)imidazol-4-yl]methyl]piperazino]pyrimidine Formula: C20H30N6O3S MolecularWeight: 434.5556

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC=C(N1CC2CCCO2)CN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CCCS(=O)(=O)C1=NC=C(N1CC2CCCO2)CN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H30N6O3S/c1-2-13-30(27,28)20-23-14-17(26(20)16-18-5-3-12-29-18)15-24-8-10-25(11-9-24)19-21-6-4-7-22-19/h4,6-7,14,18H,2-3,5,8-13,15-16H2,1H3