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

Systemtic Name: 1-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(1-ethylpyrazol-4-yl)urea Openeye Name: 1-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(1-ethylpyrazol-4-yl)urea CAS Name: 1-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(1-ethyl-4-pyrazolyl)urea IUPAC Name: 1-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(1-ethylpyrazol-4-yl)urea Traditional Name: 1-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-3-(1-ethylpyrazol-4-yl)urea Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)NC(=O)NC(C)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCN1C=C(C=N1)NC(=O)NC(C)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C17H22N4O3/c1-3-21-11-14(10-18-21)20-17(22)19-12(2)13-5-6-15-16(9-13)24-8-4-7-23-15/h5-6,9-12H,3-4,7-8H2,1-2H3,(H2,19,20,22)