1-[4-(4-bromanylpyrazol-1-yl)phenyl]-3-butyl-urea

Systemtic Name: 1-[4-(4-bromanylpyrazol-1-yl)phenyl]-3-butyl-urea Openeye Name: 1-[4-(4-bromopyrazol-1-yl)phenyl]-3-butyl-urea CAS Name: 1-[4-(4-bromo-1-pyrazolyl)phenyl]-3-butylurea IUPAC Name: 1-[4-(4-bromopyrazol-1-yl)phenyl]-3-butylurea Traditional Name: 1-[4-(4-bromopyrazol-1-yl)phenyl]-3-butyl-urea Formula: C14H17BrN4O MolecularWeight: 337.21498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC=C(C=C1)N2C=C(C=N2)Br

Isomeric SMILES

CCCCNC(=O)NC1=CC=C(C=C1)N2C=C(C=N2)Br

InChI

InChI=1S/C14H17BrN4O/c1-2-3-8-16-14(20)18-12-4-6-13(7-5-12)19-10-11(15)9-17-19/h4-7,9-10H,2-3,8H2,1H3,(H2,16,18,20)