N-[2-(cyclohexen-1-yl)ethyl]-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-methylsulfanyl-4-propyl-pyrimidine-5-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-(methylthio)-4-propyl-5-pyrimidinecarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-methylsulfanyl-4-propylpyrimidine-5-carboxamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(methylthio)-4-propyl-pyrimidine-5-carboxamide Formula: C17H25N3OS MolecularWeight: 319.4649

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC=C1C(=O)NCCC2=CCCCC2)SC

Isomeric SMILES

CCCC1=NC(=NC=C1C(=O)NCCC2=CCCCC2)SC

InChI

InChI=1S/C17H25N3OS/c1-3-7-15-14(12-19-17(20-15)22-2)16(21)18-11-10-13-8-5-4-6-9-13/h8,12H,3-7,9-11H2,1-2H3,(H,18,21)