N-[2-(1-methylbenzimidazol-2-yl)ethyl]-2-[(2R)-7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanamide

Systemtic Name: N-[2-(1-methylbenzimidazol-2-yl)ethyl]-2-[(2R)-7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanamide Openeye Name: N-[2-(1-methylbenzimidazol-2-yl)ethyl]-2-[(2R)-7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide CAS Name: N-[2-(1-methyl-2-benzimidazolyl)ethyl]-2-[(2R)-7-methyl-2-(3-thiophenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide IUPAC Name: N-[2-(1-methylbenzimidazol-2-yl)ethyl]-2-[(2R)-7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide Traditional Name: N-[2-(1-methylbenzimidazol-2-yl)ethyl]-2-[(2R)-7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(CN(C2)CC(=O)NCCC3=NC4=CC=CC=C4N3C)C5=CSC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)O[C@@H](CN(C2)CC(=O)NCCC3=NC4=CC=CC=C4N3C)C5=CSC=C5

InChI

InChI=1S/C26H28N4O2S/c1-18-7-8-23-20(13-18)14-30(15-24(32-23)19-10-12-33-17-19)16-26(31)27-11-9-25-28-21-5-3-4-6-22(21)29(25)2/h3-8,10,12-13,17,24H,9,11,14-16H2,1-2H3,(H,27,31)/t24-/m0/s1