5-chloranyl-2-methylsulfanyl-N-phenethyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-methylsulfanyl-N-phenethyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-methylsulfanyl-N-phenethyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(methylthio)-N-phenethyl-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-methylsulfanyl-N-phenethylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(methylthio)-N-phenethyl-pyrimidine-4-carboxamide Formula: C14H14ClN3OS MolecularWeight: 307.79846

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NCCC2=CC=CC=C2)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NCCC2=CC=CC=C2)Cl

InChI

InChI=1S/C14H14ClN3OS/c1-20-14-17-9-11(15)12(18-14)13(19)16-8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,16,19)