(2S)-2-[4-(cyclohexylcarbamoylamino)butanoylamino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: (2S)-2-[4-(cyclohexylcarbamoylamino)butanoylamino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: (2S)-2-[4-(cyclohexylcarbamoylamino)butanoylamino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: (2S)-2-[[4-[[(cyclohexylamino)-oxomethyl]amino]-1-oxobutyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: (2S)-2-[4-(cyclohexylcarbamoylamino)butanoylamino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: (2S)-2-[4-(cyclohexylcarbamoylamino)butanoylamino]-3-(1H-imidazol-5-yl)propionic acid Formula: C17H27N5O4 MolecularWeight: 365.42738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N5O4/c23-15(22-14(16(24)25)9-13-10-18-11-20-13)7-4-8-19-17(26)21-12-5-2-1-3-6-12/h10-12,14H,1-9H2,(H,18,20)(H,22,23)(H,24,25)(H2,19,21,26)/t14-/m0/s1