(2S)-6-azanyl-2-[[(2S)-2-azanylpropanoyl]amino]-N-[(2S)-1-[[(2S,3S)-3-methyl-1-oxidanylidene-1-[[(2S)-1-oxidanylidenepropan-2-yl]amino]pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]hexanamide

Systemtic Name: (2S)-6-azanyl-2-[[(2S)-2-azanylpropanoyl]amino]-N-[(2S)-1-[[(2S,3S)-3-methyl-1-oxidanylidene-1-[[(2S)-1-oxidanylidenepropan-2-yl]amino]pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]hexanamide Openeye Name: (2S)-6-amino-2-[[(2S)-2-aminopropanoyl]amino]-N-[(1S)-1-methyl-2-[[(1S,2S)-2-methyl-1-[[(1S)-1-methyl-2-oxo-ethyl]carbamoyl]butyl]amino]-2-oxo-ethyl]hexanamide CAS Name: (2S)-6-amino-2-[[(2S)-2-amino-1-oxopropyl]amino]-N-[(2S)-1-[[(2S,3S)-3-methyl-1-oxo-1-[[(2S)-1-oxopropan-2-yl]amino]pentan-2-yl]amino]-1-oxopropan-2-yl]hexanamide IUPAC Name: (2S)-6-amino-2-[[(2S)-2-aminopropanoyl]amino]-N-[(2S)-1-[[(2S,3S)-3-methyl-1-oxo-1-[[(2S)-1-oxopropan-2-yl]amino]pentan-2-yl]amino]-1-oxopropan-2-yl]hexanamide Traditional Name: (2S)-6-amino-2-[[(2S)-2-aminopropanoyl]amino]-N-[(1S)-2-keto-2-[[(1S,2S)-1-[[(1S)-2-keto-1-methyl-ethyl]carbamoyl]-2-methyl-butyl]amino]-1-methyl-ethyl]hexanamide Formula: C21H40N6O5 MolecularWeight: 456.5795

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H40N6O5/c1-6-12(2)17(21(32)24-13(3)11-28)27-19(30)15(5)25-20(31)16(9-7-8-10-22)26-18(29)14(4)23/h11-17H,6-10,22-23H2,1-5H3,(H,24,32)(H,25,31)(H,26,29)(H,27,30)/t12-,13-,14-,15-,16-,17-/m0/s1