4-(3-chlorophenyl)-6-methyl-2-methylsulfonyl-N-(3-phenylpropyl)pyrimidine-5-carboxamide

Systemtic Name: 4-(3-chlorophenyl)-6-methyl-2-methylsulfonyl-N-(3-phenylpropyl)pyrimidine-5-carboxamide Openeye Name: 4-(3-chlorophenyl)-6-methyl-2-methylsulfonyl-N-(3-phenylpropyl)pyrimidine-5-carboxamide CAS Name: 4-(3-chlorophenyl)-6-methyl-2-methylsulfonyl-N-(3-phenylpropyl)-5-pyrimidinecarboxamide IUPAC Name: 4-(3-chlorophenyl)-6-methyl-2-methylsulfonyl-N-(3-phenylpropyl)pyrimidine-5-carboxamide Traditional Name: 4-(3-chlorophenyl)-2-mesyl-6-methyl-N-(3-phenylpropyl)pyrimidine-5-carboxamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)NCCCC2=CC=CC=C2)C3=CC(=CC=C3)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)NCCCC2=CC=CC=C2)C3=CC(=CC=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C22H22ClN3O3S/c1-15-19(21(27)24-13-7-10-16-8-4-3-5-9-16)20(17-11-6-12-18(23)14-17)26-22(25-15)30(2,28)29/h3-6,8-9,11-12,14H,7,10,13H2,1-2H3,(H,24,27)