2-(1-adamantylcarbonyl)-5-azanyl-3-thiophen-2-yl-2,3-dihydrothiophene-4-carbonitrile

Systemtic Name: 2-(1-adamantylcarbonyl)-5-azanyl-3-thiophen-2-yl-2,3-dihydrothiophene-4-carbonitrile Openeye Name: 2-(adamantane-1-carbonyl)-5-amino-3-(2-thienyl)-2,3-dihydrothiophene-4-carbonitrile CAS Name: 2-[1-adamantyl(oxo)methyl]-5-amino-3-thiophen-2-yl-2,3-dihydrothiophene-4-carbonitrile IUPAC Name: 2-(adamantane-1-carbonyl)-5-amino-3-thiophen-2-yl-2,3-dihydrothiophene-4-carbonitrile Traditional Name: 2-(adamantane-1-carbonyl)-5-amino-3-(2-thienyl)-2,3-dihydrothiophene-4-carbonitrile Formula: C20H22N2OS2 MolecularWeight: 370.53148

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)C4C(C(=C(S4)N)C#N)C5=CC=CS5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)C4C(C(=C(S4)N)C#N)C5=CC=CS5

InChI

InChI=1S/C20H22N2OS2/c21-10-14-16(15-2-1-3-24-15)17(25-19(14)22)18(23)20-7-11-4-12(8-20)6-13(5-11)9-20/h1-3,11-13,16-17H,4-9,22H2