5-[(4-methoxyphenyl)methyl]-2,4-dimethyl-6-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidine

Systemtic Name: 5-[(4-methoxyphenyl)methyl]-2,4-dimethyl-6-[4-(phenylsulfonyl)piperazin-1-yl]pyrimidine Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-5-[(4-methoxyphenyl)methyl]-2,6-dimethyl-pyrimidine CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-5-[(4-methoxyphenyl)methyl]-2,6-dimethylpyrimidine IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-5-[(4-methoxyphenyl)methyl]-2,6-dimethylpyrimidine Traditional Name: 4-(4-besylpiperazino)-2,6-dimethyl-5-p-anisyl-pyrimidine Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C24H28N4O3S/c1-18-23(17-20-9-11-21(31-3)12-10-20)24(26-19(2)25-18)27-13-15-28(16-14-27)32(29,30)22-7-5-4-6-8-22/h4-12H,13-17H2,1-3H3