5-[(2,5-dimethylphenyl)methyl]-4-methyl-2-phenyl-6-(4-propan-2-ylsulfonylpiperazin-1-yl)pyrimidine

Systemtic Name: 5-[(2,5-dimethylphenyl)methyl]-4-methyl-2-phenyl-6-(4-propan-2-ylsulfonylpiperazin-1-yl)pyrimidine Openeye Name: 5-[(2,5-dimethylphenyl)methyl]-4-(4-isopropylsulfonylpiperazin-1-yl)-6-methyl-2-phenyl-pyrimidine CAS Name: 5-[(2,5-dimethylphenyl)methyl]-4-methyl-2-phenyl-6-(4-propan-2-ylsulfonyl-1-piperazinyl)pyrimidine IUPAC Name: 5-[(2,5-dimethylphenyl)methyl]-4-methyl-2-phenyl-6-(4-propan-2-ylsulfonylpiperazin-1-yl)pyrimidine Traditional Name: 5-(2,5-dimethylbenzyl)-4-(4-isopropylsulfonylpiperazino)-6-methyl-2-phenyl-pyrimidine Formula: C27H34N4O2S MolecularWeight: 478.64946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CC2=C(N=C(N=C2N3CCN(CC3)S(=O)(=O)C(C)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC2=C(N=C(N=C2N3CCN(CC3)S(=O)(=O)C(C)C)C4=CC=CC=C4)C

InChI

InChI=1S/C27H34N4O2S/c1-19(2)34(32,33)31-15-13-30(14-16-31)27-25(18-24-17-20(3)11-12-21(24)4)22(5)28-26(29-27)23-9-7-6-8-10-23/h6-12,17,19H,13-16,18H2,1-5H3