4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-[2-(phenylmethyl)phenyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-[2-(phenylmethyl)phenyl]-1,4-diazepane-1-carboxamide Openeye Name: N-(2-benzylphenyl)-4-[2-(tert-butylamino)-2-oxo-ethyl]-1,4-diazepane-1-carboxamide CAS Name: 4-[2-(tert-butylamino)-2-oxoethyl]-N-[2-(phenylmethyl)phenyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(2-benzylphenyl)-4-[2-(tert-butylamino)-2-oxoethyl]-1,4-diazepane-1-carboxamide Traditional Name: N-(2-benzylphenyl)-4-[2-(tert-butylamino)-2-keto-ethyl]-1,4-diazepane-1-carboxamide Formula: C25H34N4O2 MolecularWeight: 422.56306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCCN(CC1)C(=O)NC2=CC=CC=C2CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCCN(CC1)C(=O)NC2=CC=CC=C2CC3=CC=CC=C3

InChI

InChI=1S/C25H34N4O2/c1-25(2,3)27-23(30)19-28-14-9-15-29(17-16-28)24(31)26-22-13-8-7-12-21(22)18-20-10-5-4-6-11-20/h4-8,10-13H,9,14-19H2,1-3H3,(H,26,31)(H,27,30)