5-chloranyl-2-methylsulfanyl-N-[(2-phenoxypyridin-4-yl)methyl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-methylsulfanyl-N-[(2-phenoxypyridin-4-yl)methyl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-methylsulfanyl-N-[(2-phenoxy-4-pyridyl)methyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(methylthio)-N-[(2-phenoxy-4-pyridinyl)methyl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-methylsulfanyl-N-[(2-phenoxypyridin-4-yl)methyl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(methylthio)-N-[(2-phenoxy-4-pyridyl)methyl]pyrimidine-4-carboxamide Formula: C18H15ClN4O2S MolecularWeight: 386.8553

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NCC2=CC(=NC=C2)OC3=CC=CC=C3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NCC2=CC(=NC=C2)OC3=CC=CC=C3)Cl

InChI

InChI=1S/C18H15ClN4O2S/c1-26-18-22-11-14(19)16(23-18)17(24)21-10-12-7-8-20-15(9-12)25-13-5-3-2-4-6-13/h2-9,11H,10H2,1H3,(H,21,24)