tert-butyl N-[(2S)-5-azanyl-1-[[(2S)-2-[[(2S)-6-azanyl-1-oxidanylidene-hexan-2-yl]amino]-4-methyl-pentanoyl]amino]-1,5-bis(oxidanylidene)pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-5-azanyl-1-[[(2S)-2-[[(2S)-6-azanyl-1-oxidanylidene-hexan-2-yl]amino]-4-methyl-pentanoyl]amino]-1,5-bis(oxidanylidene)pentan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-4-amino-1-[[(2S)-2-[[(1S)-5-amino-1-formyl-pentyl]amino]-4-methyl-pentanoyl]carbamoyl]-4-oxo-butyl]carbamate CAS Name: N-[(2S)-5-amino-1-[[(2S)-2-[[(2S)-6-amino-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentyl]amino]-1,5-dioxopentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-5-amino-1-[[(2S)-2-[[(2S)-6-amino-1-oxohexan-2-yl]amino]-4-methylpentanoyl]amino]-1,5-dioxopentan-2-yl]carbamate Traditional Name: N-[(1S)-4-amino-1-[[(2S)-2-[[(1S)-5-amino-1-formyl-pentyl]amino]-4-methyl-pentanoyl]carbamoyl]-4-keto-butyl]carbamic acid tert-butyl ester Formula: C22H41N5O6 MolecularWeight: 471.59084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(=O)C(CCC(=O)N)NC(=O)OC(C)(C)C)NC(CCCCN)C=O

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC(=O)[C@H](CCC(=O)N)NC(=O)OC(C)(C)C)N[C@@H](CCCCN)C=O

InChI

InChI=1S/C22H41N5O6/c1-14(2)12-17(25-15(13-28)8-6-7-11-23)20(31)27-19(30)16(9-10-18(24)29)26-21(32)33-22(3,4)5/h13-17,25H,6-12,23H2,1-5H3,(H2,24,29)(H,26,32)(H,27,30,31)/t15-,16-,17-/m0/s1