N-(3-oxidanyl-1-adamantyl)-2-(2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethanamide

Systemtic Name: N-(3-oxidanyl-1-adamantyl)-2-(2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethanamide Openeye Name: N-(3-hydroxy-1-adamantyl)-2-[2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide CAS Name: N-(3-hydroxy-1-adamantyl)-2-[2-(3-thiophenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide IUPAC Name: N-(3-hydroxy-1-adamantyl)-2-(2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)acetamide Traditional Name: N-(3-hydroxy-1-adamantyl)-2-[2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)NC(=O)CN4CC(OC5=CC=CC=C5C4)C6=CSC=C6

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)O)NC(=O)CN4CC(OC5=CC=CC=C5C4)C6=CSC=C6

InChI

InChI=1S/C25H30N2O3S/c28-23(26-24-8-17-7-18(9-24)11-25(29,10-17)16-24)14-27-12-19-3-1-2-4-21(19)30-22(13-27)20-5-6-31-15-20/h1-6,15,17-18,22,29H,7-14,16H2,(H,26,28)