2-methylsulfanyl-4-phenyl-N-propyl-pyrimidine-5-carboxamide

Systemtic Name: 2-methylsulfanyl-4-phenyl-N-propyl-pyrimidine-5-carboxamide Openeye Name: 2-methylsulfanyl-4-phenyl-N-propyl-pyrimidine-5-carboxamide CAS Name: 2-(methylthio)-4-phenyl-N-propyl-5-pyrimidinecarboxamide IUPAC Name: 2-methylsulfanyl-4-phenyl-N-propylpyrimidine-5-carboxamide Traditional Name: 2-(methylthio)-4-phenyl-N-propyl-pyrimidine-5-carboxamide Formula: C15H17N3OS MolecularWeight: 287.37998

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CN=C(N=C1C2=CC=CC=C2)SC

Isomeric SMILES

CCCNC(=O)C1=CN=C(N=C1C2=CC=CC=C2)SC

InChI

InChI=1S/C15H17N3OS/c1-3-9-16-14(19)12-10-17-15(20-2)18-13(12)11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,16,19)