N-(2-adamantyl)-1-(4-cyanophenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-adamantyl)-1-(4-cyanophenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(2-adamantyl)-1-(4-cyanophenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-(2-adamantyl)-1-(4-cyanophenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(2-adamantyl)-1-(4-cyanophenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-(2-adamantyl)-1-(4-cyanophenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)C#N)C(=O)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)C#N)C(=O)NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C22H27N3O3S/c23-13-14-3-5-19(6-4-14)29(27,28)25-7-1-2-20(25)22(26)24-21-17-9-15-8-16(11-17)12-18(21)10-15/h3-6,15-18,20-21H,1-2,7-12H2,(H,24,26)