N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-[(2S)-7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanamide

Systemtic Name: N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-[(2S)-7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanamide Openeye Name: N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-[(2S)-7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide CAS Name: N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-[(2S)-7-methyl-2-(3-thiophenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide IUPAC Name: N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-[(2S)-7-methyl-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide Traditional Name: N-[2-(6-methoxy-1H-benzimidazol-2-yl)ethyl]-2-[(2S)-7-methyl-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(CN(C2)CC(=O)NCCC3=NC4=C(N3)C=C(C=C4)OC)C5=CSC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)O[C@H](CN(C2)CC(=O)NCCC3=NC4=C(N3)C=C(C=C4)OC)C5=CSC=C5

InChI

InChI=1S/C26H28N4O3S/c1-17-3-6-23-19(11-17)13-30(14-24(33-23)18-8-10-34-16-18)15-26(31)27-9-7-25-28-21-5-4-20(32-2)12-22(21)29-25/h3-6,8,10-12,16,24H,7,9,13-15H2,1-2H3,(H,27,31)(H,28,29)/t24-/m1/s1