2-(3-butyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanylethanenitrile

Systemtic Name: 2-(3-butyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanylethanenitrile Openeye Name: 2-(3-butyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanylacetonitrile CAS Name: 2-[(3-butyl-4-oxo-2-thieno[3,2-d]pyrimidinyl)thio]acetonitrile IUPAC Name: 2-(3-butyl-4-oxothieno[3,2-d]pyrimidin-2-yl)sulfanylacetonitrile Traditional Name: 2-[(3-butyl-4-keto-thieno[3,2-d]pyrimidin-2-yl)thio]acetonitrile Formula: C12H13N3OS2 MolecularWeight: 279.38112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C=CS2)N=C1SCC#N

Isomeric SMILES

CCCCN1C(=O)C2=C(C=CS2)N=C1SCC#N

InChI

InChI=1S/C12H13N3OS2/c1-2-3-6-15-11(16)10-9(4-7-17-10)14-12(15)18-8-5-13/h4,7H,2-3,6,8H2,1H3