2-(3-fluorophenyl)-4,5-dimethyl-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine

Systemtic Name: 2-(3-fluorophenyl)-4,5-dimethyl-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine Openeye Name: 2-(3-fluorophenyl)-4,5-dimethyl-6-[4-(2-naphthylsulfonyl)piperazin-1-yl]pyrimidine CAS Name: 2-(3-fluorophenyl)-4,5-dimethyl-6-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]pyrimidine IUPAC Name: 2-(3-fluorophenyl)-4,5-dimethyl-6-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine Traditional Name: 2-(3-fluorophenyl)-4,5-dimethyl-6-[4-(2-naphthylsulfonyl)piperazino]pyrimidine Formula: C26H25FN4O2S MolecularWeight: 476.565703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C5=CC(=CC=C5)F)C

Isomeric SMILES

CC1=C(N=C(N=C1N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C5=CC(=CC=C5)F)C

InChI

InChI=1S/C26H25FN4O2S/c1-18-19(2)28-25(22-8-5-9-23(27)16-22)29-26(18)30-12-14-31(15-13-30)34(32,33)24-11-10-20-6-3-4-7-21(20)17-24/h3-11,16-17H,12-15H2,1-2H3