1-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(3-pyrazol-1-ylpropyl)urea

Systemtic Name: 1-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(3-pyrazol-1-ylpropyl)urea Openeye Name: 1-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(3-pyrazol-1-ylpropyl)urea CAS Name: 1-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-[3-(1-pyrazolyl)propyl]urea IUPAC Name: 1-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(3-pyrazol-1-ylpropyl)urea Traditional Name: 1-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(3-pyrazol-1-ylpropyl)urea Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)NCCCN3C=CC=N3

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)NCCCN3C=CC=N3

InChI

InChI=1S/C18H24N4O3/c1-14(15-5-6-16-17(13-15)25-12-4-11-24-16)21-18(23)19-7-2-9-22-10-3-8-20-22/h3,5-6,8,10,13-14H,2,4,7,9,11-12H2,1H3,(H2,19,21,23)