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

Systemtic Name: 3-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-1-methyl-1-[(1-methylpyrazol-4-yl)methyl]urea Openeye Name: 3-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-1-methyl-1-[(1-methylpyrazol-4-yl)methyl]urea CAS Name: 3-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-1-methyl-1-[(1-methyl-4-pyrazolyl)methyl]urea IUPAC Name: 3-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-1-methyl-1-[(1-methylpyrazol-4-yl)methyl]urea Traditional Name: 3-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-1-methyl-1-[(1-methylpyrazol-4-yl)methyl]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)N(C)CC3=CN(N=C3)C

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)N(C)CC3=CN(N=C3)C

InChI

InChI=1S/C18H24N4O3/c1-13(15-5-6-16-17(9-15)25-8-4-7-24-16)20-18(23)21(2)11-14-10-19-22(3)12-14/h5-6,9-10,12-13H,4,7-8,11H2,1-3H3,(H,20,23)