N-[4-[(4-chlorophenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide

Systemtic Name: N-[4-[(4-chlorophenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Openeye Name: N-[4-[(4-chlorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide CAS Name: N-[4-[(4-chlorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(4-chlorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Traditional Name: N-[4-(4-chlorobenzyl)-3-keto-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Formula: C21H17ClN2O3S MolecularWeight: 412.88928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)NC(=O)C3=CC=CS3)OCC(=O)N1CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C2=C(C=CC(=C2)NC(=O)C3=CC=CS3)OCC(=O)N1CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H17ClN2O3S/c22-16-5-3-14(4-6-16)11-24-12-15-10-17(7-8-18(15)27-13-20(24)25)23-21(26)19-2-1-9-28-19/h1-10H,11-13H2,(H,23,26)