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

Systemtic Name: 3-methyl-5-[5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylthiophen-2-yl]-1,2-oxazole Openeye Name: 3-methyl-5-[5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonyl-2-thienyl]isoxazole CAS Name: 3-methyl-5-[5-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]-2-thiophenyl]isoxazole IUPAC Name: 3-methyl-5-[5-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylthiophen-2-yl]-1,2-oxazole Traditional Name: 3-methyl-5-[5-[4-(2-pyrimidyl)piperazino]sulfonyl-2-thienyl]isoxazole Formula: C16H17N5O3S2 MolecularWeight: 391.46788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C2=CC=C(S2)S(=O)(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=NOC(=C1)C2=CC=C(S2)S(=O)(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C16H17N5O3S2/c1-12-11-13(24-19-12)14-3-4-15(25-14)26(22,23)21-9-7-20(8-10-21)16-17-5-2-6-18-16/h2-6,11H,7-10H2,1H3