1-[(2-cyano-6-isocyano-pyridin-4-yl)amino]-3-[3-(2,4-dimethylphenoxy)propyl]urea

Systemtic Name: 1-[(2-cyano-6-isocyano-pyridin-4-yl)amino]-3-[3-(2,4-dimethylphenoxy)propyl]urea Openeye Name: 1-[(2-cyano-6-isocyano-4-pyridyl)amino]-3-[3-(2,4-dimethylphenoxy)propyl]urea CAS Name: 1-[(2-cyano-6-isocyano-4-pyridinyl)amino]-3-[3-(2,4-dimethylphenoxy)propyl]urea IUPAC Name: 1-[(2-cyano-6-isocyanopyridin-4-yl)amino]-3-[3-(2,4-dimethylphenoxy)propyl]urea Traditional Name: 1-[(2-cyano-6-isocyano-4-pyridyl)amino]-3-[3-(2,4-dimethylphenoxy)propyl]urea Formula: C19H20N6O2 MolecularWeight: 364.4011

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCNC(=O)NNC2=CC(=NC(=C2)C#N)[N+]#[C-])C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCNC(=O)NNC2=CC(=NC(=C2)C#N)[N+]#[C-])C

InChI

InChI=1S/C19H20N6O2/c1-13-5-6-17(14(2)9-13)27-8-4-7-22-19(26)25-24-15-10-16(12-20)23-18(11-15)21-3/h5-6,9-11H,4,7-8H2,1-2H3,(H,23,24)(H2,22,25,26)