5-chloranyl-2-ethylsulfanyl-N-quinolin-8-yl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-ethylsulfanyl-N-quinolin-8-yl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-ethylsulfanyl-N-(8-quinolyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(ethylthio)-N-(8-quinolinyl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-ethylsulfanyl-N-quinolin-8-ylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(ethylthio)-N-(8-quinolyl)pyrimidine-4-carboxamide Formula: C16H13ClN4OS MolecularWeight: 344.81862

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)NC2=CC=CC3=C2N=CC=C3)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)NC2=CC=CC3=C2N=CC=C3)Cl

InChI

InChI=1S/C16H13ClN4OS/c1-2-23-16-19-9-11(17)14(21-16)15(22)20-12-7-3-5-10-6-4-8-18-13(10)12/h3-9H,2H2,1H3,(H,20,22)