2-methylpropyl N-[(1S)-2-[[(2S)-1-[[(3S)-1-[[2-[[(1S)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl]amino]-2-oxidanylidene-ethyl]amino]-2,2-bis(oxidanyl)-1-oxidanylidene-hexan-3-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-cyclohexyl-2-oxidanylidene-ethyl]carbamate

Systemtic Name: 2-methylpropyl N-[(1S)-2-[[(2S)-1-[[(3S)-1-[[2-[[(1S)-2-azanyl-2-oxidanylidene-1-phenyl-ethyl]amino]-2-oxidanylidene-ethyl]amino]-2,2-bis(oxidanyl)-1-oxidanylidene-hexan-3-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-cyclohexyl-2-oxidanylidene-ethyl]carbamate Openeye Name: isobutyl N-[(1S)-2-[[(1S)-1-[[(1S)-1-[2-[[2-[[(1S)-2-amino-2-oxo-1-phenyl-ethyl]amino]-2-oxo-ethyl]amino]-1,1-dihydroxy-2-oxo-ethyl]butyl]carbamoyl]-3-methyl-butyl]amino]-1-cyclohexyl-2-oxo-ethyl]carbamate CAS Name: N-[(1S)-2-[[(2S)-1-[[(3S)-1-[[2-[[(1S)-2-amino-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-2,2-dihydroxy-1-oxohexan-3-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-cyclohexyl-2-oxoethyl]carbamic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-[(1S)-2-[[(2S)-1-[[(3S)-1-[[2-[[(1S)-2-amino-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-2,2-dihydroxy-1-oxohexan-3-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-cyclohexyl-2-oxoethyl]carbamate Traditional Name: N-[(1S)-2-[[(1S)-1-[[(1S)-1-[2-[[2-[[(1S)-2-amino-2-keto-1-phenyl-ethyl]amino]-2-keto-ethyl]amino]-1,1-dihydroxy-2-keto-ethyl]butyl]carbamoyl]-3-methyl-butyl]amino]-1-cyclohexyl-2-keto-ethyl]carbamic acid isobutyl ester Formula: C35H56N6O9 MolecularWeight: 704.85394

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C(=O)NCC(=O)NC(C1=CC=CC=C1)C(=O)N)(O)O)NC(=O)C(CC(C)C)NC(=O)C(C2CCCCC2)NC(=O)OCC(C)C

Isomeric SMILES

CCC[C@@H](C(C(=O)NCC(=O)N[C@@H](C1=CC=CC=C1)C(=O)N)(O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C2CCCCC2)NC(=O)OCC(C)C

InChI

InChI=1S/C35H56N6O9/c1-6-13-26(35(48,49)33(46)37-19-27(42)40-28(30(36)43)23-14-9-7-10-15-23)39-31(44)25(18-21(2)3)38-32(45)29(24-16-11-8-12-17-24)41-34(47)50-20-22(4)5/h7,9-10,14-15,21-22,24-26,28-29,48-49H,6,8,11-13,16-20H2,1-5H3,(H2,36,43)(H,37,46)(H,38,45)(H,39,44)(H,40,42)(H,41,47)/t25-,26-,28-,29-/m0/s1