5-[[(2S)-1-(2-aminocarbonylpyrrolidin-1-yl)-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-4-azanyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[(2S)-1-(2-aminocarbonylpyrrolidin-1-yl)-3-(1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]amino]-4-azanyl-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-[[(1S)-2-(2-carbamoylpyrrolidin-1-yl)-1-(1H-imidazol-5-ylmethyl)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 4-amino-5-[[(2S)-1-(2-carbamoyl-1-pyrrolidinyl)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 4-amino-5-[[(2S)-1-(2-carbamoylpyrrolidin-1-yl)-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 4-amino-5-[[(1S)-2-(2-carbamoylpyrrolidino)-1-(1H-imidazol-5-ylmethyl)-2-keto-ethyl]amino]-5-keto-valeric acid Formula: C16H24N6O5 MolecularWeight: 380.39896

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CN=CN2)NC(=O)C(CCC(=O)O)N)C(=O)N

Isomeric SMILES

C1CC(N(C1)C(=O)[C@H](CC2=CN=CN2)NC(=O)C(CCC(=O)O)N)C(=O)N

InChI

InChI=1S/C16H24N6O5/c17-10(3-4-13(23)24)15(26)21-11(6-9-7-19-8-20-9)16(27)22-5-1-2-12(22)14(18)25/h7-8,10-12H,1-6,17H2,(H2,18,25)(H,19,20)(H,21,26)(H,23,24)/t10?,11-,12?/m0/s1