5-chloranyl-N-[3-[methyl(phenyl)amino]propyl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[3-[methyl(phenyl)amino]propyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[3-(N-methylanilino)propyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[3-(N-methylanilino)propyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[3-(N-methylanilino)propyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[3-(N-methylanilino)propyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C16H19ClN4OS MolecularWeight: 350.86626

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=NC(=NC=C1Cl)SC)C2=CC=CC=C2

Isomeric SMILES

CN(CCCNC(=O)C1=NC(=NC=C1Cl)SC)C2=CC=CC=C2

InChI

InChI=1S/C16H19ClN4OS/c1-21(12-7-4-3-5-8-12)10-6-9-18-15(22)14-13(17)11-19-16(20-14)23-2/h3-5,7-8,11H,6,9-10H2,1-2H3,(H,18,22)