N-[3-[2-(3-bromanyl-1-adamantyl)ethanoylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[2-(3-bromanyl-1-adamantyl)ethanoylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[[2-(3-bromo-1-adamantyl)acetyl]amino]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[2-(3-bromo-1-adamantyl)-1-oxoethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[[2-(3-bromo-1-adamantyl)acetyl]amino]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[[2-(3-bromo-1-adamantyl)acetyl]amino]phenyl]thiophene-2-carboxamide Formula: C23H25BrN2O2S MolecularWeight: 473.4258

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)NC4=CC=CC(=C4)NC(=O)C5=CC=CS5

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)NC4=CC=CC(=C4)NC(=O)C5=CC=CS5

InChI

InChI=1S/C23H25BrN2O2S/c24-23-11-15-7-16(12-23)10-22(9-15,14-23)13-20(27)25-17-3-1-4-18(8-17)26-21(28)19-5-2-6-29-19/h1-6,8,15-16H,7,9-14H2,(H,25,27)(H,26,28)