5-(4-chlorophenyl)sulfanyl-N-phenyl-2-(phenylmethylsulfanyl)pyrimidine-4-carboxamide

Systemtic Name: 5-(4-chlorophenyl)sulfanyl-N-phenyl-2-(phenylmethylsulfanyl)pyrimidine-4-carboxamide Openeye Name: 2-benzylsulfanyl-5-(4-chlorophenyl)sulfanyl-N-phenyl-pyrimidine-4-carboxamide CAS Name: 5-[(4-chlorophenyl)thio]-N-phenyl-2-(phenylmethylthio)-4-pyrimidinecarboxamide IUPAC Name: 2-benzylsulfanyl-5-(4-chlorophenyl)sulfanyl-N-phenylpyrimidine-4-carboxamide Traditional Name: 2-(benzylthio)-5-[(4-chlorophenyl)thio]-N-phenyl-pyrimidine-4-carboxamide Formula: C24H18ClN3OS2 MolecularWeight: 464.00222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H18ClN3OS2/c25-18-11-13-20(14-12-18)31-21-15-26-24(30-16-17-7-3-1-4-8-17)28-22(21)23(29)27-19-9-5-2-6-10-19/h1-15H,16H2,(H,27,29)