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

Systemtic Name: N-[4-(3-methylbutyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2-thiophen-2-yl-ethanamide Openeye Name: N-(4-isopentyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-2-(2-thienyl)acetamide CAS Name: N-[4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-thiophen-2-ylacetamide IUPAC Name: N-[4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-thiophen-2-ylacetamide Traditional Name: N-(4-isoamyl-3-keto-5H-1,4-benzoxazepin-7-yl)-2-(2-thienyl)acetamide Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1CC2=C(C=CC(=C2)NC(=O)CC3=CC=CS3)OCC1=O

Isomeric SMILES

CC(C)CCN1CC2=C(C=CC(=C2)NC(=O)CC3=CC=CS3)OCC1=O

InChI

InChI=1S/C20H24N2O3S/c1-14(2)7-8-22-12-15-10-16(5-6-18(15)25-13-20(22)24)21-19(23)11-17-4-3-9-26-17/h3-6,9-10,14H,7-8,11-13H2,1-2H3,(H,21,23)