1-(5-cyclopropyl-1H-pyrazol-3-yl)-3-[3-(3-oxidanylbut-1-ynyl)phenyl]urea

Systemtic Name: 1-(5-cyclopropyl-1H-pyrazol-3-yl)-3-[3-(3-oxidanylbut-1-ynyl)phenyl]urea Openeye Name: 1-(5-cyclopropyl-1H-pyrazol-3-yl)-3-[3-(3-hydroxybut-1-ynyl)phenyl]urea CAS Name: 1-(5-cyclopropyl-1H-pyrazol-3-yl)-3-[3-(3-hydroxybut-1-ynyl)phenyl]urea IUPAC Name: 1-(5-cyclopropyl-1H-pyrazol-3-yl)-3-[3-(3-hydroxybut-1-ynyl)phenyl]urea Traditional Name: 1-(5-cyclopropyl-1H-pyrazol-3-yl)-3-[3-(3-hydroxybut-1-ynyl)phenyl]urea Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC(=CC=C1)NC(=O)NC2=NNC(=C2)C3CC3)O

Isomeric SMILES

CC(C#CC1=CC(=CC=C1)NC(=O)NC2=NNC(=C2)C3CC3)O

InChI

InChI=1S/C17H18N4O2/c1-11(22)5-6-12-3-2-4-14(9-12)18-17(23)19-16-10-15(20-21-16)13-7-8-13/h2-4,9-11,13,22H,7-8H2,1H3,(H3,18,19,20,21,23)