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

Systemtic Name: N-(2-adamantylideneamino)-2-(4-oxidanylidene-6-propyl-thieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-(2-adamantylideneamino)-2-(4-oxo-6-propyl-thieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-(2-adamantylideneamino)-2-(4-oxo-6-propyl-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-(2-adamantylideneamino)-2-(4-oxo-6-propylthieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: N-(2-adamantylideneamino)-2-(4-keto-6-propyl-thieno[2,3-d]pyrimidin-3-yl)propionamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O2S/c1-3-4-17-10-18-21(29-17)23-11-26(22(18)28)12(2)20(27)25-24-19-15-6-13-5-14(8-15)9-16(19)7-13/h10-16H,3-9H2,1-2H3,(H,25,27)