4-chloranyl-2-methylsulfanyl-N-phenethyl-6-(phenethylamino)pyrimidine-5-carboxamide

Systemtic Name: 4-chloranyl-2-methylsulfanyl-N-phenethyl-6-(phenethylamino)pyrimidine-5-carboxamide Openeye Name: 4-chloro-2-methylsulfanyl-N-phenethyl-6-(phenethylamino)pyrimidine-5-carboxamide CAS Name: 4-chloro-2-(methylthio)-N-phenethyl-6-(phenethylamino)-5-pyrimidinecarboxamide IUPAC Name: 4-chloro-2-methylsulfanyl-N-phenethyl-6-(phenethylamino)pyrimidine-5-carboxamide Traditional Name: 4-chloro-2-(methylthio)-N-phenethyl-6-(phenethylamino)pyrimidine-5-carboxamide Formula: C22H23ClN4OS MolecularWeight: 426.96222

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)Cl)C(=O)NCCC2=CC=CC=C2)NCCC3=CC=CC=C3

Isomeric SMILES

CSC1=NC(=C(C(=N1)Cl)C(=O)NCCC2=CC=CC=C2)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H23ClN4OS/c1-29-22-26-19(23)18(21(28)25-15-13-17-10-6-3-7-11-17)20(27-22)24-14-12-16-8-4-2-5-9-16/h2-11H,12-15H2,1H3,(H,25,28)(H,24,26,27)