N-[2-ethyl-3-oxidanylidene-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-5H-1,4-benzoxazepin-7-yl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[2-ethyl-3-oxidanylidene-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-5H-1,4-benzoxazepin-7-yl]-2-thiophen-2-yl-ethanamide Openeye Name: N-(2-ethyl-3-oxo-4-tetralin-1-yl-5H-1,4-benzoxazepin-7-yl)-2-(2-thienyl)acetamide CAS Name: N-[2-ethyl-3-oxo-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-5H-1,4-benzoxazepin-7-yl]-2-thiophen-2-ylacetamide IUPAC Name: N-[2-ethyl-3-oxo-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-5H-1,4-benzoxazepin-7-yl]-2-thiophen-2-ylacetamide Traditional Name: N-(2-ethyl-3-keto-4-tetralin-1-yl-5H-1,4-benzoxazepin-7-yl)-2-(2-thienyl)acetamide Formula: C27H28N2O3S MolecularWeight: 460.58782

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)CC3=CC=CS3)C4CCCC5=CC=CC=C45

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)CC3=CC=CS3)C4CCCC5=CC=CC=C45

InChI

InChI=1S/C27H28N2O3S/c1-2-24-27(31)29(23-11-5-8-18-7-3-4-10-22(18)23)17-19-15-20(12-13-25(19)32-24)28-26(30)16-21-9-6-14-33-21/h3-4,6-7,9-10,12-15,23-24H,2,5,8,11,16-17H2,1H3,(H,28,30)