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

Systemtic Name: 4-[2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethoxy]benzonitrile CAS Name: 4-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]ethoxy]benzonitrile IUPAC Name: 4-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethoxy]benzonitrile Traditional Name: 4-[2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]ethoxy]benzonitrile Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCCOC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCCOC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H17N3O2S/c1-2-3-13-10-15(20)19-16(18-13)22-9-8-21-14-6-4-12(11-17)5-7-14/h4-7,10H,2-3,8-9H2,1H3,(H,18,19,20)