N-(1-cyanocycloheptyl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-cyanocycloheptyl)-2-(4-oxidanylidene-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-(1-cyanocycloheptyl)acetamide CAS Name: N-(1-cyanocycloheptyl)-2-[(4-oxo-3-prop-2-enyl-2-thieno[3,2-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-(4-oxo-3-prop-2-enylthieno[3,2-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-thieno[3,2-d]pyrimidin-2-yl)thio]-N-(1-cyanocycloheptyl)acetamide Formula: C19H22N4O2S2 MolecularWeight: 402.53358

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC3(CCCCCC3)C#N

Isomeric SMILES

C=CCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC3(CCCCCC3)C#N

InChI

InChI=1S/C19H22N4O2S2/c1-2-10-23-17(25)16-14(7-11-26-16)21-18(23)27-12-15(24)22-19(13-20)8-5-3-4-6-9-19/h2,7,11H,1,3-6,8-10,12H2,(H,22,24)