N-(1-adamantylcarbamoyl)-2-(3-ethyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-(3-ethyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-(3-ethyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[(3-ethyl-4-oxo-2-thieno[3,2-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-(3-ethyl-4-oxothieno[3,2-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[(3-ethyl-4-keto-thieno[3,2-d]pyrimidin-2-yl)thio]acetamide Formula: C21H26N4O3S2 MolecularWeight: 446.58614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H26N4O3S2/c1-2-25-18(27)17-15(3-4-29-17)22-20(25)30-11-16(26)23-19(28)24-21-8-12-5-13(9-21)7-14(6-12)10-21/h3-4,12-14H,2,5-11H2,1H3,(H2,23,24,26,28)