5-bromanyl-2-[(4-chlorophenyl)methylsulfanyl]-N-(4-methylphenyl)pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-2-[(4-chlorophenyl)methylsulfanyl]-N-(4-methylphenyl)pyrimidine-4-carboxamide Openeye Name: 5-bromo-2-[(4-chlorophenyl)methylsulfanyl]-N-(p-tolyl)pyrimidine-4-carboxamide CAS Name: 5-bromo-2-[(4-chlorophenyl)methylthio]-N-(4-methylphenyl)-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-2-[(4-chlorophenyl)methylsulfanyl]-N-(4-methylphenyl)pyrimidine-4-carboxamide Traditional Name: 5-bromo-2-[(4-chlorobenzyl)thio]-N-(p-tolyl)pyrimidine-4-carboxamide Formula: C19H15BrClN3OS MolecularWeight: 448.7639

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Br)SCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Br)SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H15BrClN3OS/c1-12-2-8-15(9-3-12)23-18(25)17-16(20)10-22-19(24-17)26-11-13-4-6-14(21)7-5-13/h2-10H,11H2,1H3,(H,23,25)