N-(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)-1-thiophen-2-yl-cyclopentane-1-carboxamide

Systemtic Name: N-(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)-1-thiophen-2-yl-cyclopentane-1-carboxamide Openeye Name: N-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-1-(2-thienyl)cyclopentanecarboxamide CAS Name: N-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-1-thiophen-2-yl-1-cyclopentanecarboxamide IUPAC Name: N-(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-1-thiophen-2-ylcyclopentane-1-carboxamide Traditional Name: N-(5-ethyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)-1-(2-thienyl)cyclopentanecarboxamide Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C3(CCCC3)C4=CC=CS4)OCC(C1=O)(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C3(CCCC3)C4=CC=CS4)OCC(C1=O)(C)C

InChI

InChI=1S/C23H28N2O3S/c1-4-25-17-10-9-16(14-18(17)28-15-22(2,3)21(25)27)24-20(26)23(11-5-6-12-23)19-8-7-13-29-19/h7-10,13-14H,4-6,11-12,15H2,1-3H3,(H,24,26)