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

Systemtic Name: 5-chloranyl-2-ethylsulfanyl-N-phenethyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-ethylsulfanyl-N-phenethyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(ethylthio)-N-phenethyl-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-ethylsulfanyl-N-phenethylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(ethylthio)-N-phenethyl-pyrimidine-4-carboxamide Formula: C15H16ClN3OS MolecularWeight: 321.82504

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)NCCC2=CC=CC=C2)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)NCCC2=CC=CC=C2)Cl

InChI

InChI=1S/C15H16ClN3OS/c1-2-21-15-18-10-12(16)13(19-15)14(20)17-9-8-11-6-4-3-5-7-11/h3-7,10H,2,8-9H2,1H3,(H,17,20)