(2S)-2-[[(2S)-2-[[(2S)-2-azanyl-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]-N-[(2S)-1-(1H-imidazol-5-yl)-3-oxidanylidene-propan-2-yl]-4-methyl-pentanamide

Systemtic Name: (2S)-2-[[(2S)-2-[[(2S)-2-azanyl-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]-N-[(2S)-1-(1H-imidazol-5-yl)-3-oxidanylidene-propan-2-yl]-4-methyl-pentanamide Openeye Name: (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]-N-[(1S)-1-formyl-2-(1H-imidazol-5-yl)ethyl]-4-methyl-pentanamide CAS Name: (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methyl-1-oxobutyl]amino]-4-methyl-1-oxopentyl]amino]-N-[(2S)-1-(1H-imidazol-5-yl)-3-oxopropan-2-yl]-4-methylpentanamide IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-N-[(2S)-1-(1H-imidazol-5-yl)-3-oxopropan-2-yl]-4-methylpentanamide Traditional Name: (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]amino]-N-[(1S)-1-formyl-2-(1H-imidazol-5-yl)ethyl]-4-methyl-valeramide Formula: C23H40N6O4 MolecularWeight: 464.6015

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CN=CN1)C=O)NC(=O)C(CC(C)C)NC(=O)C(C(C)C)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CC1=CN=CN1)C=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)N

InChI

InChI=1S/C23H40N6O4/c1-13(2)7-18(21(31)27-17(11-30)9-16-10-25-12-26-16)28-22(32)19(8-14(3)4)29-23(33)20(24)15(5)6/h10-15,17-20H,7-9,24H2,1-6H3,(H,25,26)(H,27,31)(H,28,32)(H,29,33)/t17-,18-,19-,20-/m0/s1