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

Systemtic Name: N-[2-methyl-3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-2-thiophen-2-yl-ethanamide Openeye Name: N-(4-benzyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-2-(2-thienyl)acetamide CAS Name: N-[2-methyl-3-oxo-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-2-thiophen-2-ylacetamide IUPAC Name: N-(4-benzyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-2-thiophen-2-ylacetamide Traditional Name: N-(4-benzyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)-2-(2-thienyl)acetamide Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)CC3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)CC3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O3S/c1-16-23(27)25(14-17-6-3-2-4-7-17)15-18-12-19(9-10-21(18)28-16)24-22(26)13-20-8-5-11-29-20/h2-12,16H,13-15H2,1H3,(H,24,26)