N-[1-(1-adamantyl)ethyl]-2-[(4-cyanophenyl)sulfonyl-phenyl-amino]ethanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-2-[(4-cyanophenyl)sulfonyl-phenyl-amino]ethanamide Openeye Name: N-[1-(1-adamantyl)ethyl]-2-(N-(4-cyanophenyl)sulfonylanilino)acetamide CAS Name: N-[1-(1-adamantyl)ethyl]-2-(N-(4-cyanophenyl)sulfonylanilino)acetamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-2-(N-(4-cyanophenyl)sulfonylanilino)acetamide Traditional Name: N-[1-(1-adamantyl)ethyl]-2-(N-(4-cyanophenyl)sulfonylanilino)acetamide Formula: C27H31N3O3S MolecularWeight: 477.61834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CN(C4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CN(C4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H31N3O3S/c1-19(27-14-21-11-22(15-27)13-23(12-21)16-27)29-26(31)18-30(24-5-3-2-4-6-24)34(32,33)25-9-7-20(17-28)8-10-25/h2-10,19,21-23H,11-16,18H2,1H3,(H,29,31)