tert-butyl N-[1-[[3-(4-aminophenyl)-1-[[4-methyl-1-oxidanylidene-1-(phenethylamino)pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[[3-(4-aminophenyl)-1-[[4-methyl-1-oxidanylidene-1-(phenethylamino)pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[[1-[(4-aminophenyl)methyl]-2-[[3-methyl-1-(phenethylcarbamoyl)butyl]amino]-2-oxo-ethyl]carbamoyl]pentyl]carbamate CAS Name: N-[1-[[3-(4-aminophenyl)-1-[[4-methyl-1-oxo-1-(phenethylamino)pentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[[3-(4-aminophenyl)-1-[[4-methyl-1-oxo-1-(phenethylamino)pentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]carbamate Traditional Name: N-[1-[[1-(4-aminobenzyl)-2-keto-2-[[3-methyl-1-(phenethylcarbamoyl)butyl]amino]ethyl]carbamoyl]pentyl]carbamic acid tert-butyl ester Formula: C34H51N5O5 MolecularWeight: 609.79924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(CC1=CC=C(C=C1)N)C(=O)NC(CC(C)C)C(=O)NCCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC(C(=O)NC(CC1=CC=C(C=C1)N)C(=O)NC(CC(C)C)C(=O)NCCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C34H51N5O5/c1-7-8-14-27(39-33(43)44-34(4,5)6)31(41)38-29(22-25-15-17-26(35)18-16-25)32(42)37-28(21-23(2)3)30(40)36-20-19-24-12-10-9-11-13-24/h9-13,15-18,23,27-29H,7-8,14,19-22,35H2,1-6H3,(H,36,40)(H,37,42)(H,38,41)(H,39,43)