N-[(5S,7R)-3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]carbonyl-1-adamantyl]ethanamide

Systemtic Name: N-[(5S,7R)-3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]carbonyl-1-adamantyl]ethanamide Openeye Name: N-[(5S,7R)-3-[4-(3-fluorophenyl)sulfonylpiperazine-1-carbonyl]-1-adamantyl]acetamide CAS Name: N-[(5S,7R)-3-[[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1-adamantyl]acetamide IUPAC Name: N-[(5S,7R)-3-[4-(3-fluorophenyl)sulfonylpiperazine-1-carbonyl]-1-adamantyl]acetamide Traditional Name: N-[(5S,7R)-3-[4-(3-fluorophenyl)sulfonylpiperazine-1-carbonyl]-1-adamantyl]acetamide Formula: C23H30FN3O4S MolecularWeight: 463.565403

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=CC(=C5)F

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=CC(=C5)F

InChI

InChI=1S/C23H30FN3O4S/c1-16(28)25-23-13-17-9-18(14-23)12-22(11-17,15-23)21(29)26-5-7-27(8-6-26)32(30,31)20-4-2-3-19(24)10-20/h2-4,10,17-18H,5-9,11-15H2,1H3,(H,25,28)/t17-,18+,22?,23?