N-(1-adamantyl)-4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]benzamide

Systemtic Name: N-(1-adamantyl)-4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]benzamide Openeye Name: N-(1-adamantyl)-4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]benzamide CAS Name: N-(1-adamantyl)-4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]benzamide IUPAC Name: N-(1-adamantyl)-4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]benzamide Traditional Name: N-(1-adamantyl)-4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]benzamide Formula: C25H29BrN2O4S MolecularWeight: 533.47776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H29BrN2O4S/c1-2-32-22-8-5-20(26)12-23(22)33(30,31)28-21-6-3-19(4-7-21)24(29)27-25-13-16-9-17(14-25)11-18(10-16)15-25/h3-8,12,16-18,28H,2,9-11,13-15H2,1H3,(H,27,29)