4-methyl-6-(2-methylphenyl)-2-methylsulfanyl-N-(3-phenylpropyl)pyrimidine-5-carboxamide

Systemtic Name: 4-methyl-6-(2-methylphenyl)-2-methylsulfanyl-N-(3-phenylpropyl)pyrimidine-5-carboxamide Openeye Name: 4-methyl-2-methylsulfanyl-6-(o-tolyl)-N-(3-phenylpropyl)pyrimidine-5-carboxamide CAS Name: 4-methyl-6-(2-methylphenyl)-2-(methylthio)-N-(3-phenylpropyl)-5-pyrimidinecarboxamide IUPAC Name: 4-methyl-6-(2-methylphenyl)-2-methylsulfanyl-N-(3-phenylpropyl)pyrimidine-5-carboxamide Traditional Name: 4-methyl-2-(methylthio)-6-(o-tolyl)-N-(3-phenylpropyl)pyrimidine-5-carboxamide Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C(=NC(=N2)SC)C)C(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C2=C(C(=NC(=N2)SC)C)C(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C23H25N3OS/c1-16-10-7-8-14-19(16)21-20(17(2)25-23(26-21)28-3)22(27)24-15-9-13-18-11-5-4-6-12-18/h4-8,10-12,14H,9,13,15H2,1-3H3,(H,24,27)