N-(1-adamantyl)-3-azanyl-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: N-(1-adamantyl)-3-azanyl-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: N-(1-adamantyl)-3-amino-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: N-(1-adamantyl)-3-amino-6-(3-methoxyphenyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: N-(1-adamantyl)-3-amino-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: N-(1-adamantyl)-3-amino-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NC3=C(C=C2)C(=C(S3)C(=O)NC45CC6CC(C4)CC(C6)C5)N

Isomeric SMILES

COC1=CC=CC(=C1)C2=NC3=C(C=C2)C(=C(S3)C(=O)NC45CC6CC(C4)CC(C6)C5)N

InChI

InChI=1S/C25H27N3O2S/c1-30-18-4-2-3-17(10-18)20-6-5-19-21(26)22(31-24(19)27-20)23(29)28-25-11-14-7-15(12-25)9-16(8-14)13-25/h2-6,10,14-16H,7-9,11-13,26H2,1H3,(H,28,29)