4-[4-(4-fluoranyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-6-pyrrolidin-1-yl-pyrimidine

Systemtic Name: 4-[4-(4-fluoranyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-6-pyrrolidin-1-yl-pyrimidine Openeye Name: 4-[4-(4-fluoro-3-methyl-phenyl)sulfonylpiperazin-1-yl]-6-pyrrolidin-1-yl-pyrimidine CAS Name: 4-[4-(4-fluoro-3-methylphenyl)sulfonyl-1-piperazinyl]-6-(1-pyrrolidinyl)pyrimidine IUPAC Name: 4-[4-(4-fluoro-3-methylphenyl)sulfonylpiperazin-1-yl]-6-pyrrolidin-1-ylpyrimidine Traditional Name: 4-[4-(4-fluoro-3-methyl-phenyl)sulfonylpiperazino]-6-pyrrolidino-pyrimidine Formula: C19H24FN5O2S MolecularWeight: 405.489563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCC4)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCC4)F

InChI

InChI=1S/C19H24FN5O2S/c1-15-12-16(4-5-17(15)20)28(26,27)25-10-8-24(9-11-25)19-13-18(21-14-22-19)23-6-2-3-7-23/h4-5,12-14H,2-3,6-11H2,1H3