(2S)-2-[6-(cyclohexylcarbamoylamino)hexanoylamino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: (2S)-2-[6-(cyclohexylcarbamoylamino)hexanoylamino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: (2S)-2-[6-(cyclohexylcarbamoylamino)hexanoylamino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: (2S)-2-[[6-[[(cyclohexylamino)-oxomethyl]amino]-1-oxohexyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: (2S)-2-[6-(cyclohexylcarbamoylamino)hexanoylamino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: (2S)-2-[6-(cyclohexylcarbamoylamino)hexanoylamino]-3-(1H-imidazol-5-yl)propionic acid Formula: C19H31N5O4 MolecularWeight: 393.48054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31N5O4/c25-17(24-16(18(26)27)11-15-12-20-13-22-15)9-5-2-6-10-21-19(28)23-14-7-3-1-4-8-14/h12-14,16H,1-11H2,(H,20,22)(H,24,25)(H,26,27)(H2,21,23,28)/t16-/m0/s1