1-adamantyl-[3-azanyl-4-(methoxymethyl)-6-methyl-thieno[2,3-b]pyridin-2-yl]methanone

Systemtic Name: 1-adamantyl-[3-azanyl-4-(methoxymethyl)-6-methyl-thieno[2,3-b]pyridin-2-yl]methanone Openeye Name: 1-adamantyl-[3-amino-4-(methoxymethyl)-6-methyl-thieno[2,3-b]pyridin-2-yl]methanone CAS Name: 1-adamantyl-[3-amino-4-(methoxymethyl)-6-methyl-2-thieno[2,3-b]pyridinyl]methanone IUPAC Name: 1-adamantyl-[3-amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-2-yl]methanone Traditional Name: 1-adamantyl-[3-amino-4-(methoxymethyl)-6-methyl-thieno[2,3-b]pyridin-2-yl]methanone Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)COC)C(=C(S2)C(=O)C34CC5CC(C3)CC(C5)C4)N

Isomeric SMILES

CC1=NC2=C(C(=C1)COC)C(=C(S2)C(=O)C34CC5CC(C3)CC(C5)C4)N

InChI

InChI=1S/C21H26N2O2S/c1-11-3-15(10-25-2)16-17(22)18(26-20(16)23-11)19(24)21-7-12-4-13(8-21)6-14(5-12)9-21/h3,12-14H,4-10,22H2,1-2H3