4-(3-fluorophenyl)-6-methoxy-1-[(2-methyl-1,2,4-triazol-3-yl)methyl]-2-oxidanylidene-quinoline-3-carbonitrile

Systemtic Name: 4-(3-fluorophenyl)-6-methoxy-1-[(2-methyl-1,2,4-triazol-3-yl)methyl]-2-oxidanylidene-quinoline-3-carbonitrile Openeye Name: 4-(3-fluorophenyl)-6-methoxy-1-[(2-methyl-1,2,4-triazol-3-yl)methyl]-2-oxo-quinoline-3-carbonitrile CAS Name: 4-(3-fluorophenyl)-6-methoxy-1-[(2-methyl-1,2,4-triazol-3-yl)methyl]-2-oxo-3-quinolinecarbonitrile IUPAC Name: 4-(3-fluorophenyl)-6-methoxy-1-[(2-methyl-1,2,4-triazol-3-yl)methyl]-2-oxoquinoline-3-carbonitrile Traditional Name: 4-(3-fluorophenyl)-2-keto-6-methoxy-1-[(2-methyl-1,2,4-triazol-3-yl)methyl]quinoline-3-carbonitrile Formula: C21H16FN5O2 MolecularWeight: 389.382443

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC=N1)CN2C3=C(C=C(C=C3)OC)C(=C(C2=O)C#N)C4=CC(=CC=C4)F

Isomeric SMILES

CN1C(=NC=N1)CN2C3=C(C=C(C=C3)OC)C(=C(C2=O)C#N)C4=CC(=CC=C4)F

InChI

InChI=1S/C21H16FN5O2/c1-26-19(24-12-25-26)11-27-18-7-6-15(29-2)9-16(18)20(17(10-23)21(27)28)13-4-3-5-14(22)8-13/h3-9,12H,11H2,1-2H3