1-adamantyl-[6-(1-adamantyl)-3-azanyl-thieno[2,3-b]pyridin-2-yl]methanone

Systemtic Name: 1-adamantyl-[6-(1-adamantyl)-3-azanyl-thieno[2,3-b]pyridin-2-yl]methanone Openeye Name: 1-adamantyl-[6-(1-adamantyl)-3-amino-thieno[2,3-b]pyridin-2-yl]methanone CAS Name: 1-adamantyl-[6-(1-adamantyl)-3-amino-2-thieno[2,3-b]pyridinyl]methanone IUPAC Name: 1-adamantyl-[6-(1-adamantyl)-3-aminothieno[2,3-b]pyridin-2-yl]methanone Traditional Name: 1-adamantyl-[6-(1-adamantyl)-3-amino-thieno[2,3-b]pyridin-2-yl]methanone Formula: C28H34N2OS MolecularWeight: 446.64736

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NC5=C(C=C4)C(=C(S5)C(=O)C67CC8CC(C6)CC(C8)C7)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NC5=C(C=C4)C(=C(S5)C(=O)C67CC8CC(C6)CC(C8)C7)N

InChI

InChI=1S/C28H34N2OS/c29-23-21-1-2-22(27-9-15-3-16(10-27)5-17(4-15)11-27)30-26(21)32-24(23)25(31)28-12-18-6-19(13-28)8-20(7-18)14-28/h1-2,15-20H,3-14,29H2