3-[6-[3-(2-azanylethyl)oxiran-2-yl]-4-oxidanylidene-hexyl]-1-methyl-1-(pyridin-2-ylmethyl)urea

Systemtic Name: 3-[6-[3-(2-azanylethyl)oxiran-2-yl]-4-oxidanylidene-hexyl]-1-methyl-1-(pyridin-2-ylmethyl)urea Openeye Name: 3-[6-[3-(2-aminoethyl)oxiran-2-yl]-4-oxo-hexyl]-1-methyl-1-(2-pyridylmethyl)urea CAS Name: 3-[6-[3-(2-aminoethyl)-2-oxiranyl]-4-oxohexyl]-1-methyl-1-(2-pyridinylmethyl)urea IUPAC Name: 3-[6-[3-(2-aminoethyl)oxiran-2-yl]-4-oxohexyl]-1-methyl-1-(pyridin-2-ylmethyl)urea Traditional Name: 3-[6-[3-(2-aminoethyl)oxiran-2-yl]-4-keto-hexyl]-1-methyl-1-(2-pyridylmethyl)urea Formula: C18H28N4O3 MolecularWeight: 348.43992

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=N1)C(=O)NCCCC(=O)CCC2C(O2)CCN

Isomeric SMILES

CN(CC1=CC=CC=N1)C(=O)NCCCC(=O)CCC2C(O2)CCN

InChI

InChI=1S/C18H28N4O3/c1-22(13-14-5-2-3-11-20-14)18(24)21-12-4-6-15(23)7-8-16-17(25-16)9-10-19/h2-3,5,11,16-17H,4,6-10,12-13,19H2,1H3,(H,21,24)