(2S)-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-2-[(2-azido-2-methyl-propanoyl)amino]pentanamide

Systemtic Name: (2S)-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-2-[(2-azido-2-methyl-propanoyl)amino]pentanamide Openeye Name: (2S)-N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-2-[(2-azido-2-methyl-propanoyl)amino]pentanamide CAS Name: (2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-2-[(2-azido-2-methyl-1-oxopropyl)amino]pentanamide IUPAC Name: (2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-2-[(2-azido-2-methylpropanoyl)amino]pentanamide Traditional Name: (2S)-N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-2-[(2-azido-2-methyl-propanoyl)amino]valeramide Formula: C18H26N6O3 MolecularWeight: 374.43744

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC(CC1=CC=CC=C1)C(=O)N)NC(=O)C(C)(C)N=[N+]=[N-]

Isomeric SMILES

CCC[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N)NC(=O)C(C)(C)N=[N+]=[N-]

InChI

InChI=1S/C18H26N6O3/c1-4-8-13(22-17(27)18(2,3)23-24-20)16(26)21-14(15(19)25)11-12-9-6-5-7-10-12/h5-7,9-10,13-14H,4,8,11H2,1-3H3,(H2,19,25)(H,21,26)(H,22,27)/t13-,14-/m0/s1