4-[2-azanyl-4-[3-(2-chloranyl-5-fluoranyl-pyridin-3-yl)phenyl]-1-methyl-5-oxidanylidene-imidazol-4-yl]-1-propyl-pyrrole-2-carbonitrile

Systemtic Name: 4-[2-azanyl-4-[3-(2-chloranyl-5-fluoranyl-pyridin-3-yl)phenyl]-1-methyl-5-oxidanylidene-imidazol-4-yl]-1-propyl-pyrrole-2-carbonitrile Openeye Name: 4-[2-amino-4-[3-(2-chloro-5-fluoro-3-pyridyl)phenyl]-1-methyl-5-oxo-imidazol-4-yl]-1-propyl-pyrrole-2-carbonitrile CAS Name: 4-[2-amino-4-[3-(2-chloro-5-fluoro-3-pyridinyl)phenyl]-1-methyl-5-oxo-4-imidazolyl]-1-propyl-2-pyrrolecarbonitrile IUPAC Name: 4-[2-amino-4-[3-(2-chloro-5-fluoropyridin-3-yl)phenyl]-1-methyl-5-oxoimidazol-4-yl]-1-propylpyrrole-2-carbonitrile Traditional Name: 4-[2-amino-4-[3-(2-chloro-5-fluoro-3-pyridyl)phenyl]-5-keto-1-methyl-2-imidazolin-4-yl]-1-propyl-pyrrole-2-carbonitrile Formula: C23H20ClFN6O MolecularWeight: 450.895903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C=C1C#N)C2(C(=O)N(C(=N2)N)C)C3=CC=CC(=C3)C4=CC(=CN=C4Cl)F

Isomeric SMILES

CCCN1C=C(C=C1C#N)C2(C(=O)N(C(=N2)N)C)C3=CC=CC(=C3)C4=CC(=CN=C4Cl)F

InChI

InChI=1S/C23H20ClFN6O/c1-3-7-31-13-16(9-18(31)11-26)23(21(32)30(2)22(27)29-23)15-6-4-5-14(8-15)19-10-17(25)12-28-20(19)24/h4-6,8-10,12-13H,3,7H2,1-2H3,(H2,27,29)