1-heptan-2-yl-3-[(6-pyrazol-1-ylpyridin-3-yl)methyl]urea

Systemtic Name: 1-heptan-2-yl-3-[(6-pyrazol-1-ylpyridin-3-yl)methyl]urea Openeye Name: 1-(1-methylhexyl)-3-[(6-pyrazol-1-yl-3-pyridyl)methyl]urea CAS Name: 1-heptan-2-yl-3-[[6-(1-pyrazolyl)-3-pyridinyl]methyl]urea IUPAC Name: 1-heptan-2-yl-3-[(6-pyrazol-1-ylpyridin-3-yl)methyl]urea Traditional Name: 1-(1-methylhexyl)-3-[(6-pyrazol-1-yl-3-pyridyl)methyl]urea Formula: C17H25N5O MolecularWeight: 315.4133

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)NCC1=CN=C(C=C1)N2C=CC=N2

Isomeric SMILES

CCCCCC(C)NC(=O)NCC1=CN=C(C=C1)N2C=CC=N2

InChI

InChI=1S/C17H25N5O/c1-3-4-5-7-14(2)21-17(23)19-13-15-8-9-16(18-12-15)22-11-6-10-20-22/h6,8-12,14H,3-5,7,13H2,1-2H3,(H2,19,21,23)