tert-butyl 3-[[3-[2-(4-carbamimidoylphenyl)ethanoylamino]phenyl]carbonylamino]-4-[[1-[(2-methylpropan-2-yl)oxy]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: tert-butyl 3-[[3-[2-(4-carbamimidoylphenyl)ethanoylamino]phenyl]carbonylamino]-4-[[1-[(2-methylpropan-2-yl)oxy]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: tert-butyl 4-[(1-benzyl-2-tert-butoxy-2-oxo-ethyl)amino]-3-[[3-[[2-(4-carbamimidoylphenyl)acetyl]amino]benzoyl]amino]-4-oxo-butanoate CAS Name: 3-[[[3-[[2-(4-carbamimidoylphenyl)-1-oxoethyl]amino]phenyl]-oxomethyl]amino]-4-[[1-[(2-methylpropan-2-yl)oxy]-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[3-[[2-(4-carbamimidoylphenyl)acetyl]amino]benzoyl]amino]-4-[[1-[(2-methylpropan-2-yl)oxy]-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoate Traditional Name: 3-[[3-[[2-(4-amidinophenyl)acetyl]amino]benzoyl]amino]-4-[(1-benzyl-2-tert-butoxy-2-keto-ethyl)amino]-4-keto-butyric acid tert-butyl ester Formula: C37H45N5O7 MolecularWeight: 671.7825

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)C2=CC(=CC=C2)NC(=O)CC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)C2=CC(=CC=C2)NC(=O)CC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C37H45N5O7/c1-36(2,3)48-31(44)22-28(34(46)42-29(35(47)49-37(4,5)6)19-23-11-8-7-9-12-23)41-33(45)26-13-10-14-27(21-26)40-30(43)20-24-15-17-25(18-16-24)32(38)39/h7-18,21,28-29H,19-20,22H2,1-6H3,(H3,38,39)(H,40,43)(H,41,45)(H,42,46)