(2S)-2-[[(2S)-2-azanyl-3-(2-propan-2-yl-1H-imidazol-5-yl)propanoyl]amino]-5-[bis(azanyl)methylideneamino]-N-(phenylmethyl)pentanamide

Systemtic Name: (2S)-2-[[(2S)-2-azanyl-3-(2-propan-2-yl-1H-imidazol-5-yl)propanoyl]amino]-5-[bis(azanyl)methylideneamino]-N-(phenylmethyl)pentanamide Openeye Name: (2S)-2-[[(2S)-2-amino-3-(2-isopropyl-1H-imidazol-5-yl)propanoyl]amino]-N-benzyl-5-guanidino-pentanamide CAS Name: (2S)-2-[[(2S)-2-amino-1-oxo-3-(2-propan-2-yl-1H-imidazol-5-yl)propyl]amino]-5-(diaminomethylideneamino)-N-(phenylmethyl)pentanamide IUPAC Name: (2S)-2-[[(2S)-2-amino-3-(2-propan-2-yl-1H-imidazol-5-yl)propanoyl]amino]-N-benzyl-5-(diaminomethylideneamino)pentanamide Traditional Name: (2S)-2-[[(2S)-2-amino-3-(2-isopropyl-1H-imidazol-5-yl)propanoyl]amino]-N-benzyl-5-guanidino-valeramide Formula: C22H34N8O2 MolecularWeight: 442.55776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC=C(N1)CC(C(=O)NC(CCCN=C(N)N)C(=O)NCC2=CC=CC=C2)N

Isomeric SMILES

CC(C)C1=NC=C(N1)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC2=CC=CC=C2)N

InChI

InChI=1S/C22H34N8O2/c1-14(2)19-27-13-16(29-19)11-17(23)20(31)30-18(9-6-10-26-22(24)25)21(32)28-12-15-7-4-3-5-8-15/h3-5,7-8,13-14,17-18H,6,9-12,23H2,1-2H3,(H,27,29)(H,28,32)(H,30,31)(H4,24,25,26)/t17-,18-/m0/s1