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

Systemtic Name: N-[2-ethyl-3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Openeye Name: N-(4-benzyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)thiophene-2-carboxamide CAS Name: N-[2-ethyl-3-oxo-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-2-thiophenecarboxamide IUPAC Name: N-(4-benzyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)thiophene-2-carboxamide Traditional Name: N-(4-benzyl-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl)thiophene-2-carboxamide Formula: C23H22N2O3S MolecularWeight: 406.49738

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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=C4

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O3S/c1-2-19-23(27)25(14-16-7-4-3-5-8-16)15-17-13-18(10-11-20(17)28-19)24-22(26)21-9-6-12-29-21/h3-13,19H,2,14-15H2,1H3,(H,24,26)