1-(3-ethylpent-1-yn-3-yl)-3-[6-(3-ethylpent-1-yn-3-ylcarbamoylamino)hexyl]urea

Systemtic Name: 1-(3-ethylpent-1-yn-3-yl)-3-[6-(3-ethylpent-1-yn-3-ylcarbamoylamino)hexyl]urea Openeye Name: 1-(1,1-diethylprop-2-ynyl)-3-[6-(1,1-diethylprop-2-ynylcarbamoylamino)hexyl]urea CAS Name: 1-(3-ethylpent-1-yn-3-yl)-3-[6-[[(3-ethylpent-1-yn-3-ylamino)-oxomethyl]amino]hexyl]urea IUPAC Name: 1-(3-ethylpent-1-yn-3-yl)-3-[6-(3-ethylpent-1-yn-3-ylcarbamoylamino)hexyl]urea Traditional Name: 1-(1,1-diethylprop-2-ynyl)-3-[6-(1,1-diethylprop-2-ynylcarbamoylamino)hexyl]urea Formula: C22H38N4O2 MolecularWeight: 390.56272

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)NCCCCCCNC(=O)NC(CC)(CC)C#C

Isomeric SMILES

CCC(CC)(C#C)NC(=O)NCCCCCCNC(=O)NC(CC)(CC)C#C

InChI

InChI=1S/C22H38N4O2/c1-7-21(8-2,9-3)25-19(27)23-17-15-13-14-16-18-24-20(28)26-22(10-4,11-5)12-6/h1,4H,8-9,11-18H2,2-3,5-6H3,(H2,23,25,27)(H2,24,26,28)