4-(3-fluorophenyl)-6-methoxy-1-(4-methylimidazol-1-yl)isoquinoline-3-carbonitrile

Systemtic Name: 4-(3-fluorophenyl)-6-methoxy-1-(4-methylimidazol-1-yl)isoquinoline-3-carbonitrile Openeye Name: 4-(3-fluorophenyl)-6-methoxy-1-(4-methylimidazol-1-yl)isoquinoline-3-carbonitrile CAS Name: 4-(3-fluorophenyl)-6-methoxy-1-(4-methyl-1-imidazolyl)-3-isoquinolinecarbonitrile IUPAC Name: 4-(3-fluorophenyl)-6-methoxy-1-(4-methylimidazol-1-yl)isoquinoline-3-carbonitrile Traditional Name: 4-(3-fluorophenyl)-6-methoxy-1-(4-methylimidazol-1-yl)isoquinoline-3-carbonitrile Formula: C21H15FN4O MolecularWeight: 358.368403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)C2=NC(=C(C3=C2C=CC(=C3)OC)C4=CC(=CC=C4)F)C#N

Isomeric SMILES

CC1=CN(C=N1)C2=NC(=C(C3=C2C=CC(=C3)OC)C4=CC(=CC=C4)F)C#N

InChI

InChI=1S/C21H15FN4O/c1-13-11-26(12-24-13)21-17-7-6-16(27-2)9-18(17)20(19(10-23)25-21)14-4-3-5-15(22)8-14/h3-9,11-12H,1-2H3