N-[2-(4-methylphenyl)ethyl]-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide

Systemtic Name: N-[2-(4-methylphenyl)ethyl]-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide Openeye Name: 2-methylsulfanyl-4-propyl-N-[2-(p-tolyl)ethyl]pyrimidine-5-carboxamide CAS Name: N-[2-(4-methylphenyl)ethyl]-2-(methylthio)-4-propyl-5-pyrimidinecarboxamide IUPAC Name: N-[2-(4-methylphenyl)ethyl]-2-methylsulfanyl-4-propylpyrimidine-5-carboxamide Traditional Name: 2-(methylthio)-4-propyl-N-[2-(p-tolyl)ethyl]pyrimidine-5-carboxamide Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC=C1C(=O)NCCC2=CC=C(C=C2)C)SC

Isomeric SMILES

CCCC1=NC(=NC=C1C(=O)NCCC2=CC=C(C=C2)C)SC

InChI

InChI=1S/C18H23N3OS/c1-4-5-16-15(12-20-18(21-16)23-3)17(22)19-11-10-14-8-6-13(2)7-9-14/h6-9,12H,4-5,10-11H2,1-3H3,(H,19,22)