N-[1-[[1-(tert-butylamino)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-4-methyl-pentan-2-yl]azepane-1-carboxamide

Systemtic Name: N-[1-[[1-(tert-butylamino)-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-4-methyl-pentan-2-yl]azepane-1-carboxamide Openeye Name: N-[1-[[[1-[(4-benzyloxyphenyl)methyl]-2-(tert-butylamino)-2-oxo-ethyl]amino]methyl]-3-methyl-butyl]azepane-1-carboxamide CAS Name: N-[1-[[1-(tert-butylamino)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-4-methylpentan-2-yl]-1-azepanecarboxamide IUPAC Name: N-[1-[[1-(tert-butylamino)-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-4-methylpentan-2-yl]azepane-1-carboxamide Traditional Name: N-[1-[[[1-(4-benzoxybenzyl)-2-(tert-butylamino)-2-keto-ethyl]amino]methyl]-3-methyl-butyl]azepane-1-carboxamide Formula: C33H50N4O3 MolecularWeight: 550.7751

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NC(C)(C)C)NC(=O)N3CCCCCC3

Isomeric SMILES

CC(C)CC(CNC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NC(C)(C)C)NC(=O)N3CCCCCC3

InChI

InChI=1S/C33H50N4O3/c1-25(2)21-28(35-32(39)37-19-11-6-7-12-20-37)23-34-30(31(38)36-33(3,4)5)22-26-15-17-29(18-16-26)40-24-27-13-9-8-10-14-27/h8-10,13-18,25,28,30,34H,6-7,11-12,19-24H2,1-5H3,(H,35,39)(H,36,38)