tert-butyl N-[(5S,6E)-6-(aminocarbonylhydrazinylidene)-5-[[(2S)-2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-3-methyl-butanoyl]amino]hexyl]carbamate

Systemtic Name: tert-butyl N-[(5S,6E)-6-(aminocarbonylhydrazinylidene)-5-[[(2S)-2-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]-3-methyl-butanoyl]amino]hexyl]carbamate Openeye Name: tert-butyl N-[(5S,6E)-5-[[(2S)-2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-3-methyl-butanoyl]amino]-6-(carbamoylhydrazono)hexyl]carbamate CAS Name: N-[(5S,6E)-5-[[(2S)-2-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]-3-methyl-1-oxobutyl]amino]-6-(carbamoylhydrazinylidene)hexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(5S,6E)-5-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-6-(carbamoylhydrazinylidene)hexyl]carbamate Traditional Name: N-[(5S,6E)-5-[[(2S)-2-[[(2S)-2-amino-4-methyl-pentanoyl]amino]-3-methyl-butanoyl]amino]-6-semicarbazono-hexyl]carbamic acid tert-butyl ester Formula: C23H45N7O5 MolecularWeight: 499.6473

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C(C)C)C(=O)NC(CCCCNC(=O)OC(C)(C)C)C=NNC(=O)N)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)/C=N/NC(=O)N)N

InChI

InChI=1S/C23H45N7O5/c1-14(2)12-17(24)19(31)29-18(15(3)4)20(32)28-16(13-27-30-21(25)33)10-8-9-11-26-22(34)35-23(5,6)7/h13-18H,8-12,24H2,1-7H3,(H,26,34)(H,28,32)(H,29,31)(H3,25,30,33)/b27-13+/t16-,17-,18-/m0/s1