N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-fluorophenyl)sulfanyl-ethanamide

Systemtic Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-fluorophenyl)sulfanyl-ethanamide Openeye Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-fluorophenyl)sulfanyl-acetamide CAS Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(4-fluorophenyl)thio]acetamide IUPAC Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-(4-fluorophenyl)sulfanylacetamide Traditional Name: N-(1-adamantyl)-N-(2-cyanoethyl)-2-[(4-fluorophenyl)thio]acetamide Formula: C21H25FN2OS MolecularWeight: 372.499403

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N(CCC#N)C(=O)CSC4=CC=C(C=C4)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N(CCC#N)C(=O)CSC4=CC=C(C=C4)F

InChI

InChI=1S/C21H25FN2OS/c22-18-2-4-19(5-3-18)26-14-20(25)24(7-1-6-23)21-11-15-8-16(12-21)10-17(9-15)13-21/h2-5,15-17H,1,7-14H2