5-[(4-chlorophenyl)methyl]-2,4-dimethyl-6-(4-propylsulfonylpiperazin-1-yl)pyrimidine

Systemtic Name: 5-[(4-chlorophenyl)methyl]-2,4-dimethyl-6-(4-propylsulfonylpiperazin-1-yl)pyrimidine Openeye Name: 5-[(4-chlorophenyl)methyl]-2,4-dimethyl-6-(4-propylsulfonylpiperazin-1-yl)pyrimidine CAS Name: 5-[(4-chlorophenyl)methyl]-2,4-dimethyl-6-(4-propylsulfonyl-1-piperazinyl)pyrimidine IUPAC Name: 5-[(4-chlorophenyl)methyl]-2,4-dimethyl-6-(4-propylsulfonylpiperazin-1-yl)pyrimidine Traditional Name: 5-(4-chlorobenzyl)-2,4-dimethyl-6-(4-propylsulfonylpiperazino)pyrimidine Formula: C20H27ClN4O2S MolecularWeight: 422.97198

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=C(C=C3)Cl)C)C

Isomeric SMILES

CCCS(=O)(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=C(C=C3)Cl)C)C

InChI

InChI=1S/C20H27ClN4O2S/c1-4-13-28(26,27)25-11-9-24(10-12-25)20-19(15(2)22-16(3)23-20)14-17-5-7-18(21)8-6-17/h5-8H,4,9-14H2,1-3H3