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

Systemtic Name: 5-chloranyl-N-(4-cyclopentylsulfanylphenyl)-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(4-cyclopentylsulfanylphenyl)-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[4-(cyclopentylthio)phenyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(4-cyclopentylsulfanylphenyl)-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[4-(cyclopentylthio)phenyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C17H18ClN3OS2 MolecularWeight: 379.92732

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)SC3CCCC3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)SC3CCCC3)Cl

InChI

InChI=1S/C17H18ClN3OS2/c1-23-17-19-10-14(18)15(21-17)16(22)20-11-6-8-13(9-7-11)24-12-4-2-3-5-12/h6-10,12H,2-5H2,1H3,(H,20,22)