N-(2-adamantylideneamino)-2-(4-oxidanylidene-6-propyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(2-adamantylideneamino)-2-(4-oxidanylidene-6-propyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(2-adamantylideneamino)-2-(4-oxo-6-propyl-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(2-adamantylideneamino)-2-(4-oxo-6-propyl-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: N-(2-adamantylideneamino)-2-(4-oxo-6-propylthieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: N-(2-adamantylideneamino)-2-(4-keto-6-propyl-thieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(S1)N=CN(C2=O)CC(=O)NN=C3C4CC5CC(C4)CC3C5

Isomeric SMILES

CCCC1=CC2=C(S1)N=CN(C2=O)CC(=O)NN=C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C21H26N4O2S/c1-2-3-16-9-17-20(28-16)22-11-25(21(17)27)10-18(26)23-24-19-14-5-12-4-13(7-14)8-15(19)6-12/h9,11-15H,2-8,10H2,1H3,(H,23,26)