(2S)-2-(1-adamantylcarbonyl)-3-thiophen-2-yl-cyclopropane-1,1-dicarbonitrile

Systemtic Name: (2S)-2-(1-adamantylcarbonyl)-3-thiophen-2-yl-cyclopropane-1,1-dicarbonitrile Openeye Name: (2S)-2-(adamantane-1-carbonyl)-3-(2-thienyl)cyclopropane-1,1-dicarbonitrile CAS Name: (2S)-2-[1-adamantyl(oxo)methyl]-3-thiophen-2-ylcyclopropane-1,1-dicarbonitrile IUPAC Name: (2S)-2-(adamantane-1-carbonyl)-3-thiophen-2-ylcyclopropane-1,1-dicarbonitrile Traditional Name: (2S)-2-(adamantane-1-carbonyl)-3-(2-thienyl)cyclopropane-1,1-dicarbonitrile Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)C4C(C4(C#N)C#N)C5=CC=CS5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)[C@H]4C(C4(C#N)C#N)C5=CC=CS5

InChI

InChI=1S/C20H20N2OS/c21-10-20(11-22)16(15-2-1-3-24-15)17(20)18(23)19-7-12-4-13(8-19)6-14(5-12)9-19/h1-3,12-14,16-17H,4-9H2/t12?,13?,14?,16?,17-,19?/m1/s1