N-[1-(1-adamantyl)ethyl]-2-[(2-cyanophenyl)methylsulfonyl-methyl-amino]ethanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-2-[(2-cyanophenyl)methylsulfonyl-methyl-amino]ethanamide Openeye Name: N-[1-(1-adamantyl)ethyl]-2-[(2-cyanophenyl)methylsulfonyl-methyl-amino]acetamide CAS Name: N-[1-(1-adamantyl)ethyl]-2-[(2-cyanophenyl)methylsulfonyl-methylamino]acetamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-2-[(2-cyanophenyl)methylsulfonyl-methylamino]acetamide Traditional Name: N-[1-(1-adamantyl)ethyl]-2-[(2-cyanobenzyl)sulfonyl-methyl-amino]acetamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CN(C)S(=O)(=O)CC4=CC=CC=C4C#N

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CN(C)S(=O)(=O)CC4=CC=CC=C4C#N

InChI

InChI=1S/C23H31N3O3S/c1-16(23-10-17-7-18(11-23)9-19(8-17)12-23)25-22(27)14-26(2)30(28,29)15-21-6-4-3-5-20(21)13-24/h3-6,16-19H,7-12,14-15H2,1-2H3,(H,25,27)