2-methylsulfanyl-4-phenyl-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 2-methylsulfanyl-4-phenyl-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide Openeye Name: 2-methylsulfanyl-4-phenyl-N-(3-pyridylmethyl)pyrimidine-5-carboxamide CAS Name: 2-(methylthio)-4-phenyl-N-(3-pyridinylmethyl)-5-pyrimidinecarboxamide IUPAC Name: 2-methylsulfanyl-4-phenyl-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide Traditional Name: 2-(methylthio)-4-phenyl-N-(3-pyridylmethyl)pyrimidine-5-carboxamide Formula: C18H16N4OS MolecularWeight: 336.41084

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C2=CC=CC=C2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CSC1=NC=C(C(=N1)C2=CC=CC=C2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C18H16N4OS/c1-24-18-21-12-15(16(22-18)14-7-3-2-4-8-14)17(23)20-11-13-6-5-9-19-10-13/h2-10,12H,11H2,1H3,(H,20,23)