4-[2-(3-methyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanylethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-(3-methyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanylethoxy]benzenecarbonitrile Openeye Name: 4-[2-(3-methyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanylethoxy]benzonitrile CAS Name: 4-[2-[(3-methyl-4-oxo-2-thieno[3,2-d]pyrimidinyl)thio]ethoxy]benzonitrile IUPAC Name: 4-[2-(3-methyl-4-oxothieno[3,2-d]pyrimidin-2-yl)sulfanylethoxy]benzonitrile Traditional Name: 4-[2-[(4-keto-3-methyl-thieno[3,2-d]pyrimidin-2-yl)thio]ethoxy]benzonitrile Formula: C16H13N3O2S2 MolecularWeight: 343.42332

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=CS2)N=C1SCCOC3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C(=O)C2=C(C=CS2)N=C1SCCOC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H13N3O2S2/c1-19-15(20)14-13(6-8-22-14)18-16(19)23-9-7-21-12-4-2-11(10-17)3-5-12/h2-6,8H,7,9H2,1H3