3-methyl-5-[4-methyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-phenyl]-1,2-oxazole

Systemtic Name: 3-methyl-5-[4-methyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-phenyl]-1,2-oxazole Openeye Name: 3-methyl-5-[4-methyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-phenyl]isoxazole CAS Name: 3-methyl-5-[4-methyl-3-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]phenyl]isoxazole IUPAC Name: 3-methyl-5-[4-methyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylphenyl]-1,2-oxazole Traditional Name: 3-methyl-5-[4-methyl-3-[4-(2-pyrimidyl)piperazino]sulfonyl-phenyl]isoxazole Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H21N5O3S/c1-14-4-5-16(17-12-15(2)22-27-17)13-18(14)28(25,26)24-10-8-23(9-11-24)19-20-6-3-7-21-19/h3-7,12-13H,8-11H2,1-2H3