2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]-N-(diphenylmethyl)ethanamide

Systemtic Name: 2-[4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]-N-(diphenylmethyl)ethanamide Openeye Name: N-benzhydryl-2-[4-[2-(tert-butylamino)-2-oxo-ethyl]-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-[2-(tert-butylamino)-2-oxoethyl]-1,4-diazepan-1-yl]-N-(diphenylmethyl)acetamide IUPAC Name: N-benzhydryl-2-[4-[2-(tert-butylamino)-2-oxoethyl]-1,4-diazepan-1-yl]acetamide Traditional Name: N-benzhydryl-2-[4-[2-(tert-butylamino)-2-keto-ethyl]-1,4-diazepan-1-yl]acetamide Formula: C26H36N4O2 MolecularWeight: 436.58964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCCN(CC1)CC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCCN(CC1)CC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H36N4O2/c1-26(2,3)28-24(32)20-30-16-10-15-29(17-18-30)19-23(31)27-25(21-11-6-4-7-12-21)22-13-8-5-9-14-22/h4-9,11-14,25H,10,15-20H2,1-3H3,(H,27,31)(H,28,32)