tert-butyl N-[N'-[3-[4-(3-azanylpropylamino)butylamino]propyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamate

Systemtic Name: tert-butyl N-[N'-[3-[4-(3-azanylpropylamino)butylamino]propyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamate Openeye Name: tert-butyl N-[N'-[3-[4-(3-aminopropylamino)butylamino]propyl]-N-tert-butoxycarbonyl-carbamimidoyl]carbamate CAS Name: N-[3-[4-(3-aminopropylamino)butylamino]propylimino-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[N'-[3-[4-(3-aminopropylamino)butylamino]propyl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]carbamate Traditional Name: N-[N'-[3-[4-(3-aminopropylamino)butylamino]propyl]-N-tert-butoxycarbonyl-amidino]carbamic acid tert-butyl ester Formula: C21H44N6O4 MolecularWeight: 444.61186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(=NCCCNCCCCNCCCN)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC(=NCCCNCCCCNCCCN)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H44N6O4/c1-20(2,3)30-18(28)26-17(27-19(29)31-21(4,5)6)25-16-10-15-24-13-8-7-12-23-14-9-11-22/h23-24H,7-16,22H2,1-6H3,(H2,25,26,27,28,29)