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

Systemtic Name: N-(4-butylphenyl)-5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: N-(4-butylphenyl)-5-chloro-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: N-(4-butylphenyl)-5-chloro-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: N-(4-butylphenyl)-5-chloro-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: N-(4-butylphenyl)-5-chloro-2-(methylthio)pyrimidine-4-carboxamide Formula: C16H18ClN3OS MolecularWeight: 335.85162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C16H18ClN3OS/c1-3-4-5-11-6-8-12(9-7-11)19-15(21)14-13(17)10-18-16(20-14)22-2/h6-10H,3-5H2,1-2H3,(H,19,21)