N-(3-chloranyl-4-methyl-phenyl)-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-2-(methylthio)-4-propyl-5-pyrimidinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-methylsulfanyl-4-propylpyrimidine-5-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-(methylthio)-4-propyl-pyrimidine-5-carboxamide Formula: C16H18ClN3OS MolecularWeight: 335.85162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC=C1C(=O)NC2=CC(=C(C=C2)C)Cl)SC

Isomeric SMILES

CCCC1=NC(=NC=C1C(=O)NC2=CC(=C(C=C2)C)Cl)SC

InChI

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