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

Systemtic Name: 2-[3-(2-methylpropyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanylethanenitrile Openeye Name: 2-(3-isobutyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanylacetonitrile CAS Name: 2-[[3-(2-methylpropyl)-4-oxo-2-thieno[3,2-d]pyrimidinyl]thio]acetonitrile IUPAC Name: 2-[3-(2-methylpropyl)-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanylacetonitrile Traditional Name: 2-[(3-isobutyl-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:

CC(C)CN1C(=O)C2=C(C=CS2)N=C1SCC#N

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CS2)N=C1SCC#N

InChI

InChI=1S/C12H13N3OS2/c1-8(2)7-15-11(16)10-9(3-5-17-10)14-12(15)18-6-4-13/h3,5,8H,6-7H2,1-2H3