3-(4-methylphenyl)-5-(2-methylpropylsulfonyl)-N-[(2-methylpyrimidin-5-yl)methyl]benzamide

Systemtic Name: 3-(4-methylphenyl)-5-(2-methylpropylsulfonyl)-N-[(2-methylpyrimidin-5-yl)methyl]benzamide Openeye Name: 3-isobutylsulfonyl-N-[(2-methylpyrimidin-5-yl)methyl]-5-(p-tolyl)benzamide CAS Name: 3-(4-methylphenyl)-5-(2-methylpropylsulfonyl)-N-[(2-methyl-5-pyrimidinyl)methyl]benzamide IUPAC Name: 3-(4-methylphenyl)-5-(2-methylpropylsulfonyl)-N-[(2-methylpyrimidin-5-yl)methyl]benzamide Traditional Name: 3-isobutylsulfonyl-N-[(2-methylpyrimidin-5-yl)methyl]-5-(p-tolyl)benzamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=CC(=C2)S(=O)(=O)CC(C)C)C(=O)NCC3=CN=C(N=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=CC(=C2)S(=O)(=O)CC(C)C)C(=O)NCC3=CN=C(N=C3)C

InChI

InChI=1S/C24H27N3O3S/c1-16(2)15-31(29,30)23-10-21(20-7-5-17(3)6-8-20)9-22(11-23)24(28)27-14-19-12-25-18(4)26-13-19/h5-13,16H,14-15H2,1-4H3,(H,27,28)