2-(3-fluorophenyl)-4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-6-methyl-pyrimidine

Systemtic Name: 2-(3-fluorophenyl)-4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-6-methyl-pyrimidine Openeye Name: 2-(3-fluorophenyl)-4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-6-methyl-pyrimidine CAS Name: 2-(3-fluorophenyl)-4-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-6-methylpyrimidine IUPAC Name: 2-(3-fluorophenyl)-4-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-6-methylpyrimidine Traditional Name: 2-(3-fluorophenyl)-4-[4-(4-methoxyphenyl)sulfonylpiperazino]-6-methyl-pyrimidine Formula: C22H23FN4O3S MolecularWeight: 442.506423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC(=CC=C2)F)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC(=CC=C2)F)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H23FN4O3S/c1-16-14-21(25-22(24-16)17-4-3-5-18(23)15-17)26-10-12-27(13-11-26)31(28,29)20-8-6-19(30-2)7-9-20/h3-9,14-15H,10-13H2,1-2H3