(2S)-2-[2-(cyclohexylcarbamoylamino)ethanoylamino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: (2S)-2-[2-(cyclohexylcarbamoylamino)ethanoylamino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: (2S)-2-[[2-(cyclohexylcarbamoylamino)acetyl]amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: (2S)-2-[[2-[[(cyclohexylamino)-oxomethyl]amino]-1-oxoethyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: (2S)-2-[[2-(cyclohexylcarbamoylamino)acetyl]amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: (2S)-2-[[2-(cyclohexylcarbamoylamino)acetyl]amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C15H23N5O4 MolecularWeight: 337.37422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NCC(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

C1CCC(CC1)NC(=O)NCC(=O)N[C@@H](CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C15H23N5O4/c21-13(8-17-15(24)19-10-4-2-1-3-5-10)20-12(14(22)23)6-11-7-16-9-18-11/h7,9-10,12H,1-6,8H2,(H,16,18)(H,20,21)(H,22,23)(H2,17,19,24)/t12-/m0/s1