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

Systemtic Name: N-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Openeye Name: N-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide CAS Name: N-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-thiophenecarboxamide IUPAC Name: N-[4-[(2-chlorophenyl)methyl]-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Traditional Name: N-[4-(2-chlorobenzyl)-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Formula: C23H21ClN2O3S MolecularWeight: 440.94244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CS3)CC4=CC=CC=C4Cl

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CS3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C23H21ClN2O3S/c1-2-19-23(28)26(13-15-6-3-4-7-18(15)24)14-16-12-17(9-10-20(16)29-19)25-22(27)21-8-5-11-30-21/h3-12,19H,2,13-14H2,1H3,(H,25,27)