N-[1-(1-adamantyl)ethyl]-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-(1-adamantyl)ethyl]-2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridyl)sulfanyl]acetamide CAS Name: N-[1-(1-adamantyl)ethyl]-2-[[5-(1-pyrrolidinylsulfonyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-2-(5-pyrrolidin-1-ylsulfonylpyridin-2-yl)sulfanylacetamide Traditional Name: N-[1-(1-adamantyl)ethyl]-2-[(5-pyrrolidinosulfonyl-2-pyridyl)thio]acetamide Formula: C23H33N3O3S2 MolecularWeight: 463.65642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CSC4=NC=C(C=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CSC4=NC=C(C=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C23H33N3O3S2/c1-16(23-11-17-8-18(12-23)10-19(9-17)13-23)25-21(27)15-30-22-5-4-20(14-24-22)31(28,29)26-6-2-3-7-26/h4-5,14,16-19H,2-3,6-13,15H2,1H3,(H,25,27)