2-[[1-(4-methoxy-2,6-dimethyl-phenyl)sulfonylpiperidin-2-yl]methoxy]-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine

Systemtic Name: 2-[[1-(4-methoxy-2,6-dimethyl-phenyl)sulfonylpiperidin-2-yl]methoxy]-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine Openeye Name: 2-[[1-(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-2-piperidyl]methoxy]-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine CAS Name: 2-[[1-(4-methoxy-2,6-dimethylphenyl)sulfonyl-2-piperidinyl]methoxy]-4-[4-(2-pyrimidinyl)-1-piperazinyl]pyrimidine IUPAC Name: 2-[[1-(4-methoxy-2,6-dimethylphenyl)sulfonylpiperidin-2-yl]methoxy]-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine Traditional Name: 2-[[1-(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-2-piperidyl]methoxy]-4-[4-(2-pyrimidyl)piperazino]pyrimidine Formula: C27H35N7O4S MolecularWeight: 553.6763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N2CCCCC2COC3=NC=CC(=N3)N4CCN(CC4)C5=NC=CC=N5)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N2CCCCC2COC3=NC=CC(=N3)N4CCN(CC4)C5=NC=CC=N5)C)OC

InChI

InChI=1S/C27H35N7O4S/c1-20-17-23(37-3)18-21(2)25(20)39(35,36)34-12-5-4-7-22(34)19-38-27-30-11-8-24(31-27)32-13-15-33(16-14-32)26-28-9-6-10-29-26/h6,8-11,17-18,22H,4-5,7,12-16,19H2,1-3H3