1-[(4,5-dicyano-2-methyl-phenyl)amino]-3-octyl-urea

Systemtic Name: 1-[(4,5-dicyano-2-methyl-phenyl)amino]-3-octyl-urea Openeye Name: 1-(4,5-dicyano-2-methyl-anilino)-3-octyl-urea CAS Name: 1-(4,5-dicyano-2-methylanilino)-3-octylurea IUPAC Name: 1-(4,5-dicyano-2-methylanilino)-3-octylurea Traditional Name: 1-(4,5-dicyano-2-methyl-anilino)-3-octyl-urea Formula: C18H25N5O MolecularWeight: 327.424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)NNC1=C(C=C(C(=C1)C#N)C#N)C

Isomeric SMILES

CCCCCCCCNC(=O)NNC1=C(C=C(C(=C1)C#N)C#N)C

InChI

InChI=1S/C18H25N5O/c1-3-4-5-6-7-8-9-21-18(24)23-22-17-11-16(13-20)15(12-19)10-14(17)2/h10-11,22H,3-9H2,1-2H3,(H2,21,23,24)