4-(methoxymethyl)-2-methyl-5-[(3-methylphenyl)methyl]-6-(4-methylsulfonylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-(methoxymethyl)-2-methyl-5-[(3-methylphenyl)methyl]-6-(4-methylsulfonylpiperazin-1-yl)pyrimidine Openeye Name: 4-(methoxymethyl)-2-methyl-6-(4-methylsulfonylpiperazin-1-yl)-5-(m-tolylmethyl)pyrimidine CAS Name: 4-(methoxymethyl)-2-methyl-5-[(3-methylphenyl)methyl]-6-(4-methylsulfonyl-1-piperazinyl)pyrimidine IUPAC Name: 4-(methoxymethyl)-2-methyl-5-[(3-methylphenyl)methyl]-6-(4-methylsulfonylpiperazin-1-yl)pyrimidine Traditional Name: 4-(4-mesylpiperazino)-6-(methoxymethyl)-2-methyl-5-(3-methylbenzyl)pyrimidine Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=C(N=C(N=C2N3CCN(CC3)S(=O)(=O)C)C)COC

Isomeric SMILES

CC1=CC(=CC=C1)CC2=C(N=C(N=C2N3CCN(CC3)S(=O)(=O)C)C)COC

InChI

InChI=1S/C20H28N4O3S/c1-15-6-5-7-17(12-15)13-18-19(14-27-3)21-16(2)22-20(18)23-8-10-24(11-9-23)28(4,25)26/h5-7,12H,8-11,13-14H2,1-4H3