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

Systemtic Name: 2-[[(2S)-1-(4-methoxy-2,6-dimethyl-phenyl)sulfonylpyrrolidin-2-yl]methoxy]-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine Openeye Name: 2-[[(2S)-1-(4-methoxy-2,6-dimethyl-phenyl)sulfonylpyrrolidin-2-yl]methoxy]-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine CAS Name: 2-[[(2S)-1-(4-methoxy-2,6-dimethylphenyl)sulfonyl-2-pyrrolidinyl]methoxy]-4-[4-(2-pyrimidinyl)-1-piperazinyl]pyrimidine IUPAC Name: 2-[[(2S)-1-(4-methoxy-2,6-dimethylphenyl)sulfonylpyrrolidin-2-yl]methoxy]-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine Traditional Name: 2-[[(2S)-1-(4-methoxy-2,6-dimethyl-phenyl)sulfonylpyrrolidin-2-yl]methoxy]-4-[4-(2-pyrimidyl)piperazino]pyrimidine Formula: C26H33N7O4S MolecularWeight: 539.64972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N2CCCC2COC3=NC=CC(=N3)N4CCN(CC4)C5=NC=CC=N5)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N2CCC[C@H]2COC3=NC=CC(=N3)N4CCN(CC4)C5=NC=CC=N5)C)OC

InChI

InChI=1S/C26H33N7O4S/c1-19-16-22(36-3)17-20(2)24(19)38(34,35)33-11-4-6-21(33)18-37-26-29-10-7-23(30-26)31-12-14-32(15-13-31)25-27-8-5-9-28-25/h5,7-10,16-17,21H,4,6,11-15,18H2,1-3H3/t21-/m0/s1