2-(1-adamantylcarbonyl)-3,6-bis(azanyl)thieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 2-(1-adamantylcarbonyl)-3,6-bis(azanyl)thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 2-(adamantane-1-carbonyl)-3,6-diamino-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 2-[1-adamantyl(oxo)methyl]-3,6-diamino-5-thieno[2,3-b]pyridinecarbonitrile IUPAC Name: 2-(adamantane-1-carbonyl)-3,6-diaminothieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 2-(adamantane-1-carbonyl)-3,6-diamino-thieno[2,3-b]pyridine-5-carbonitrile Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)C4=C(C5=C(S4)N=C(C(=C5)C#N)N)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)C4=C(C5=C(S4)N=C(C(=C5)C#N)N)N

InChI

InChI=1S/C19H20N4OS/c20-8-12-4-13-14(21)15(25-18(13)23-17(12)22)16(24)19-5-9-1-10(6-19)3-11(2-9)7-19/h4,9-11H,1-3,5-7,21H2,(H2,22,23)