5-[(2-fluorophenyl)methyl]-4-(methoxymethyl)-2-methyl-6-(4-methylsulfonylpiperazin-1-yl)pyrimidine

Systemtic Name: 5-[(2-fluorophenyl)methyl]-4-(methoxymethyl)-2-methyl-6-(4-methylsulfonylpiperazin-1-yl)pyrimidine Openeye Name: 5-[(2-fluorophenyl)methyl]-4-(methoxymethyl)-2-methyl-6-(4-methylsulfonylpiperazin-1-yl)pyrimidine CAS Name: 5-[(2-fluorophenyl)methyl]-4-(methoxymethyl)-2-methyl-6-(4-methylsulfonyl-1-piperazinyl)pyrimidine IUPAC Name: 5-[(2-fluorophenyl)methyl]-4-(methoxymethyl)-2-methyl-6-(4-methylsulfonylpiperazin-1-yl)pyrimidine Traditional Name: 5-(2-fluorobenzyl)-4-(4-mesylpiperazino)-6-(methoxymethyl)-2-methyl-pyrimidine Formula: C19H25FN4O3S MolecularWeight: 408.490203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)N2CCN(CC2)S(=O)(=O)C)CC3=CC=CC=C3F)COC

Isomeric SMILES

CC1=NC(=C(C(=N1)N2CCN(CC2)S(=O)(=O)C)CC3=CC=CC=C3F)COC

InChI

InChI=1S/C19H25FN4O3S/c1-14-21-18(13-27-2)16(12-15-6-4-5-7-17(15)20)19(22-14)23-8-10-24(11-9-23)28(3,25)26/h4-7H,8-13H2,1-3H3