(1E)-1-(6-butoxy-1-phenyl-pyridazin-4-ylidene)-3-pentyl-urea

Systemtic Name: (1E)-1-(6-butoxy-1-phenyl-pyridazin-4-ylidene)-3-pentyl-urea Openeye Name: (1E)-1-(6-butoxy-1-phenyl-pyridazin-4-ylidene)-3-pentyl-urea CAS Name: (1E)-1-(6-butoxy-1-phenyl-4-pyridazinylidene)-3-pentylurea IUPAC Name: (1E)-1-(6-butoxy-1-phenylpyridazin-4-ylidene)-3-pentylurea Traditional Name: (3E)-1-amyl-3-(6-butoxy-1-phenyl-pyridazin-4-ylidene)urea Formula: C20H28N4O2 MolecularWeight: 356.46192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)N=C1C=C(N(N=C1)C2=CC=CC=C2)OCCCC

Isomeric SMILES

CCCCCNC(=O)/N=C/1\C=C(N(N=C1)C2=CC=CC=C2)OCCCC

InChI

InChI=1S/C20H28N4O2/c1-3-5-10-13-21-20(25)23-17-15-19(26-14-6-4-2)24(22-16-17)18-11-8-7-9-12-18/h7-9,11-12,15-16H,3-6,10,13-14H2,1-2H3,(H,21,25)/b23-17+