N-(2,1,3-benzothiadiazol-5-ylmethyl)-3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanamide Openeye Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanamide CAS Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanamide IUPAC Name: N-(2,1,3-benzothiadiazol-5-ylmethyl)-3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanamide Traditional Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-(piazthiol-5-ylmethyl)propionamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2CN1CCC(=O)NCC3=CC4=NSN=C4C=C3)C5=CC=CC=C5

Isomeric SMILES

C1C(OC2=CC=CC=C2CN1CCC(=O)NCC3=CC4=NSN=C4C=C3)C5=CC=CC=C5

InChI

InChI=1S/C25H24N4O2S/c30-25(26-15-18-10-11-21-22(14-18)28-32-27-21)12-13-29-16-20-8-4-5-9-23(20)31-24(17-29)19-6-2-1-3-7-19/h1-11,14,24H,12-13,15-17H2,(H,26,30)