tert-butyl N-[6-azanyl-1-(naphthalen-1-ylamino)-1-oxidanylidene-hexan-2-yl]-N-[3-(phenethylcarbamoyl)oxiran-2-yl]carbonyl-carbamate

Systemtic Name: tert-butyl N-[6-azanyl-1-(naphthalen-1-ylamino)-1-oxidanylidene-hexan-2-yl]-N-[3-(phenethylcarbamoyl)oxiran-2-yl]carbonyl-carbamate Openeye Name: tert-butyl N-[5-amino-1-(1-naphthylcarbamoyl)pentyl]-N-[3-(phenethylcarbamoyl)oxirane-2-carbonyl]carbamate CAS Name: N-[6-amino-1-(1-naphthalenylamino)-1-oxohexan-2-yl]-N-[oxo-[3-[oxo-(phenethylamino)methyl]-2-oxiranyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[6-amino-1-(naphthalen-1-ylamino)-1-oxohexan-2-yl]-N-[3-(phenethylcarbamoyl)oxirane-2-carbonyl]carbamate Traditional Name: N-[5-amino-1-(1-naphthylcarbamoyl)pentyl]-N-[3-(phenethylcarbamoyl)oxirane-2-carbonyl]carbamic acid tert-butyl ester Formula: C33H40N4O6 MolecularWeight: 588.6939

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C(CCCCN)C(=O)NC1=CC=CC2=CC=CC=C21)C(=O)C3C(O3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N(C(CCCCN)C(=O)NC1=CC=CC2=CC=CC=C21)C(=O)C3C(O3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C33H40N4O6/c1-33(2,3)43-32(41)37(31(40)28-27(42-28)30(39)35-21-19-22-12-5-4-6-13-22)26(18-9-10-20-34)29(38)36-25-17-11-15-23-14-7-8-16-24(23)25/h4-8,11-17,26-28H,9-10,18-21,34H2,1-3H3,(H,35,39)(H,36,38)