3-[2-[4-[3-[bis(azanyl)methylideneamino]propyl]-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoylamino]-2-(3-cyclohexylpropanoylamino)propanoic acid

Systemtic Name: 3-[2-[4-[3-[bis(azanyl)methylideneamino]propyl]-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethanoylamino]-2-(3-cyclohexylpropanoylamino)propanoic acid Openeye Name: 2-(3-cyclohexylpropanoylamino)-3-[[2-[4-(3-guanidinopropyl)-2,5-dioxo-imidazolidin-1-yl]acetyl]amino]propanoic acid CAS Name: 2-[(3-cyclohexyl-1-oxopropyl)amino]-3-[[2-[4-[3-(diaminomethylideneamino)propyl]-2,5-dioxo-1-imidazolidinyl]-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-(3-cyclohexylpropanoylamino)-3-[[2-[4-[3-(diaminomethylideneamino)propyl]-2,5-dioxoimidazolidin-1-yl]acetyl]amino]propanoic acid Traditional Name: 2-(3-cyclohexylpropanoylamino)-3-[[2-[4-(3-guanidinopropyl)-2,5-diketo-imidazolidin-1-yl]acetyl]amino]propionic acid Formula: C21H35N7O6 MolecularWeight: 481.5459

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NC(CNC(=O)CN2C(=O)C(NC2=O)CCCN=C(N)N)C(=O)O

Isomeric SMILES

C1CCC(CC1)CCC(=O)NC(CNC(=O)CN2C(=O)C(NC2=O)CCCN=C(N)N)C(=O)O

InChI

InChI=1S/C21H35N7O6/c22-20(23)24-10-4-7-14-18(31)28(21(34)27-14)12-17(30)25-11-15(19(32)33)26-16(29)9-8-13-5-2-1-3-6-13/h13-15H,1-12H2,(H,25,30)(H,26,29)(H,27,34)(H,32,33)(H4,22,23,24)