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

Systemtic Name: 1-adamantyl-[3-azanyl-6-(4-methoxyphenyl)thieno[2,3-b]pyridin-2-yl]methanone Openeye Name: 1-adamantyl-[3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridin-2-yl]methanone CAS Name: 1-adamantyl-[3-amino-6-(4-methoxyphenyl)-2-thieno[2,3-b]pyridinyl]methanone IUPAC Name: 1-adamantyl-[3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridin-2-yl]methanone Traditional Name: 1-adamantyl-[3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridin-2-yl]methanone Formula: C25H26N2O2S MolecularWeight: 418.55114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=C(C=C2)C(=C(S3)C(=O)C45CC6CC(C4)CC(C6)C5)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=C(C=C2)C(=C(S3)C(=O)C45CC6CC(C4)CC(C6)C5)N

InChI

InChI=1S/C25H26N2O2S/c1-29-18-4-2-17(3-5-18)20-7-6-19-21(26)22(30-24(19)27-20)23(28)25-11-14-8-15(12-25)10-16(9-14)13-25/h2-7,14-16H,8-13,26H2,1H3