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

Systemtic Name: 1-heptan-2-yl-3-[(6-imidazol-1-ylpyridin-3-yl)methyl]urea Openeye Name: 1-[(6-imidazol-1-yl-3-pyridyl)methyl]-3-(1-methylhexyl)urea CAS Name: 1-heptan-2-yl-3-[[6-(1-imidazolyl)-3-pyridinyl]methyl]urea IUPAC Name: 1-heptan-2-yl-3-[(6-imidazol-1-ylpyridin-3-yl)methyl]urea Traditional Name: 1-[(6-imidazol-1-yl-3-pyridyl)methyl]-3-(1-methylhexyl)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=CN=C2

Isomeric SMILES

CCCCCC(C)NC(=O)NCC1=CN=C(C=C1)N2C=CN=C2

InChI

InChI=1S/C17H25N5O/c1-3-4-5-6-14(2)21-17(23)20-12-15-7-8-16(19-11-15)22-10-9-18-13-22/h7-11,13-14H,3-6,12H2,1-2H3,(H2,20,21,23)