2-(7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(5-oxidanyl-2-adamantyl)ethanamide

Systemtic Name: 2-(7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(5-oxidanyl-2-adamantyl)ethanamide Openeye Name: N-(5-hydroxy-2-adamantyl)-2-[7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide CAS Name: N-(5-hydroxy-2-adamantyl)-2-[7-methyl-2-(3-thiophenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide IUPAC Name: N-(5-hydroxy-2-adamantyl)-2-(7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)acetamide Traditional Name: N-(5-hydroxy-2-adamantyl)-2-[7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide Formula: C26H32N2O3S MolecularWeight: 452.60888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(CN(C2)CC(=O)NC3C4CC5CC3CC(C5)(C4)O)C6=CSC=C6

Isomeric SMILES

CC1=CC2=C(C=C1)OC(CN(C2)CC(=O)NC3C4CC5CC3CC(C5)(C4)O)C6=CSC=C6

InChI

InChI=1S/C26H32N2O3S/c1-16-2-3-22-21(6-16)12-28(13-23(31-22)18-4-5-32-15-18)14-24(29)27-25-19-7-17-8-20(25)11-26(30,9-17)10-19/h2-6,15,17,19-20,23,25,30H,7-14H2,1H3,(H,27,29)