3-[(5-butyl-2-ethoxy-1,3-dithiol-4-yl)sulfanyl]propanenitrile

Systemtic Name: 3-[(5-butyl-2-ethoxy-1,3-dithiol-4-yl)sulfanyl]propanenitrile Openeye Name: 3-[(5-butyl-2-ethoxy-1,3-dithiol-4-yl)sulfanyl]propanenitrile CAS Name: 3-[(5-butyl-2-ethoxy-1,3-dithiol-4-yl)thio]propanenitrile IUPAC Name: 3-[(5-butyl-2-ethoxy-1,3-dithiol-4-yl)sulfanyl]propanenitrile Traditional Name: 3-[(5-butyl-2-ethoxy-1,3-dithiol-4-yl)thio]propionitrile Formula: C12H19NOS3 MolecularWeight: 289.48036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(SC(S1)OCC)SCCC#N

Isomeric SMILES

CCCCC1=C(SC(S1)OCC)SCCC#N

InChI

InChI=1S/C12H19NOS3/c1-3-5-7-10-11(15-9-6-8-13)17-12(16-10)14-4-2/h12H,3-7,9H2,1-2H3