2-(4,5-dipentyl-3,6-dihydro-2H-thiopyran-2-yl)ethanenitrile

Systemtic Name: 2-(4,5-dipentyl-3,6-dihydro-2H-thiopyran-2-yl)ethanenitrile Openeye Name: 2-(4,5-dipentyl-3,6-dihydro-2H-thiopyran-2-yl)acetonitrile CAS Name: 2-(4,5-dipentyl-3,6-dihydro-2H-thiopyran-2-yl)acetonitrile IUPAC Name: 2-(4,5-dipentyl-3,6-dihydro-2H-thiopyran-2-yl)acetonitrile Traditional Name: 2-(4,5-diamyl-3,6-dihydro-2H-thiopyran-2-yl)acetonitrile Formula: C17H29NS MolecularWeight: 279.48386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(CSC(C1)CC#N)CCCCC

Isomeric SMILES

CCCCCC1=C(CSC(C1)CC#N)CCCCC

InChI

InChI=1S/C17H29NS/c1-3-5-7-9-15-13-17(11-12-18)19-14-16(15)10-8-6-4-2/h17H,3-11,13-14H2,1-2H3