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

Systemtic Name: N-[2-ethyl-4-[(4-methoxyphenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Openeye Name: N-[2-ethyl-4-[(4-methoxyphenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide CAS Name: N-[2-ethyl-4-[(4-methoxyphenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-thiophenecarboxamide IUPAC Name: N-[2-ethyl-4-[(4-methoxyphenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]thiophene-2-carboxamide Traditional Name: N-(2-ethyl-3-keto-4-p-anisyl-5H-1,4-benzoxazepin-7-yl)thiophene-2-carboxamide Formula: C24H24N2O4S MolecularWeight: 436.52336

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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=C(C=C4)OC

Isomeric SMILES

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

InChI

InChI=1S/C24H24N2O4S/c1-3-20-24(28)26(14-16-6-9-19(29-2)10-7-16)15-17-13-18(8-11-21(17)30-20)25-23(27)22-5-4-12-31-22/h4-13,20H,3,14-15H2,1-2H3,(H,25,27)