4-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]butanenitrile

Systemtic Name: 4-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]butanenitrile Openeye Name: 4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]butanenitrile CAS Name: 4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]butanenitrile IUPAC Name: 4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]butanenitrile Traditional Name: 4-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]butyronitrile Formula: C11H15N3OS MolecularWeight: 237.3213

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCCCC#N

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCCCC#N

InChI

InChI=1S/C11H15N3OS/c1-2-5-9-8-10(15)14-11(13-9)16-7-4-3-6-12/h8H,2-5,7H2,1H3,(H,13,14,15)