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

Systemtic Name: 4-[2-azanyl-4-[3-(2-fluoranylpyridin-3-yl)phenyl]-1-methyl-5-oxidanylidene-imidazol-4-yl]-1-propyl-pyrrole-2-carbonitrile Openeye Name: 4-[2-amino-4-[3-(2-fluoro-3-pyridyl)phenyl]-1-methyl-5-oxo-imidazol-4-yl]-1-propyl-pyrrole-2-carbonitrile CAS Name: 4-[2-amino-4-[3-(2-fluoro-3-pyridinyl)phenyl]-1-methyl-5-oxo-4-imidazolyl]-1-propyl-2-pyrrolecarbonitrile IUPAC Name: 4-[2-amino-4-[3-(2-fluoropyridin-3-yl)phenyl]-1-methyl-5-oxoimidazol-4-yl]-1-propylpyrrole-2-carbonitrile Traditional Name: 4-[2-amino-4-[3-(2-fluoro-3-pyridyl)phenyl]-5-keto-1-methyl-2-imidazolin-4-yl]-1-propyl-pyrrole-2-carbonitrile Formula: C23H21FN6O MolecularWeight: 416.450843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21FN6O/c1-3-10-30-14-17(12-18(30)13-25)23(21(31)29(2)22(26)28-23)16-7-4-6-15(11-16)19-8-5-9-27-20(19)24/h4-9,11-12,14H,3,10H2,1-2H3,(H2,26,28)