1-(1,3-benzodioxol-5-yl)-3-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[1-[(4-bromophenyl)methyl]-4-pyrazolyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[1-(4-bromobenzyl)pyrazol-4-yl]urea Formula: C18H15BrN4O3 MolecularWeight: 415.2407

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)NC3=CN(N=C3)CC4=CC=C(C=C4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)NC3=CN(N=C3)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C18H15BrN4O3/c19-13-3-1-12(2-4-13)9-23-10-15(8-20-23)22-18(24)21-14-5-6-16-17(7-14)26-11-25-16/h1-8,10H,9,11H2,(H2,21,22,24)