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

Systemtic Name: 5-chloranyl-N-[2-(dimethylamino)-3-phenyl-propyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[2-(dimethylamino)-3-phenyl-propyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[2-(dimethylamino)-3-phenylpropyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[2-(dimethylamino)-3-phenyl-propyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C17H21ClN4OS MolecularWeight: 364.89284

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CC1=CC=CC=C1)CNC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CN(C)C(CC1=CC=CC=C1)CNC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C17H21ClN4OS/c1-22(2)13(9-12-7-5-4-6-8-12)10-19-16(23)15-14(18)11-20-17(21-15)24-3/h4-8,11,13H,9-10H2,1-3H3,(H,19,23)