2-azanyl-4-(1,3-benzodioxol-5-yl)-6-(4-fluorophenyl)-5-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(1,3-benzodioxol-5-yl)-6-(4-fluorophenyl)-5-methyl-pyridine-3-carbonitrile Openeye Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(4-fluorophenyl)-5-methyl-pyridine-3-carbonitrile CAS Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(4-fluorophenyl)-5-methyl-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(4-fluorophenyl)-5-methylpyridine-3-carbonitrile Traditional Name: 2-amino-4-(1,3-benzodioxol-5-yl)-6-(4-fluorophenyl)-5-methyl-nicotinonitrile Formula: C20H14FN3O2 MolecularWeight: 347.342463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C2=CC3=C(C=C2)OCO3)C#N)N)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(N=C(C(=C1C2=CC3=C(C=C2)OCO3)C#N)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H14FN3O2/c1-11-18(13-4-7-16-17(8-13)26-10-25-16)15(9-22)20(23)24-19(11)12-2-5-14(21)6-3-12/h2-8H,10H2,1H3,(H2,23,24)