N-(1-adamantylcarbamoyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-ethanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-acetamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-(4-thieno[2,3-d]pyrimidinylthio)acetamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide Traditional Name: N-(1-adamantylcarbamoyl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)acetamide Formula: C19H22N4O2S2 MolecularWeight: 402.53358

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CSC4=NC=NC5=C4C=CS5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CSC4=NC=NC5=C4C=CS5

InChI

InChI=1S/C19H22N4O2S2/c24-15(9-27-17-14-1-2-26-16(14)20-10-21-17)22-18(25)23-19-6-11-3-12(7-19)5-13(4-11)8-19/h1-2,10-13H,3-9H2,(H2,22,23,24,25)