N-(4-aminocarbonylphenyl)-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-(4-aminocarbonylphenyl)-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: N-(4-carbamoylphenyl)-5-chloro-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: N-(4-carbamoylphenyl)-5-chloro-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: N-(4-carbamoylphenyl)-5-chloro-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: N-(4-carbamoylphenyl)-5-chloro-2-(methylthio)pyrimidine-4-carboxamide Formula: C13H11ClN4O2S MolecularWeight: 322.77004

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)C(=O)N)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)C(=O)N)Cl

InChI

InChI=1S/C13H11ClN4O2S/c1-21-13-16-6-9(14)10(18-13)12(20)17-8-4-2-7(3-5-8)11(15)19/h2-6H,1H3,(H2,15,19)(H,17,20)