4-[4-(1,3-benzodioxol-5-yl)-5-(2-methylsulfanylpyrimidin-4-yl)-1H-imidazol-2-yl]benzenecarbonitrile

Systemtic Name: 4-[4-(1,3-benzodioxol-5-yl)-5-(2-methylsulfanylpyrimidin-4-yl)-1H-imidazol-2-yl]benzenecarbonitrile Openeye Name: 4-[4-(1,3-benzodioxol-5-yl)-5-(2-methylsulfanylpyrimidin-4-yl)-1H-imidazol-2-yl]benzonitrile CAS Name: 4-[4-(1,3-benzodioxol-5-yl)-5-[2-(methylthio)-4-pyrimidinyl]-1H-imidazol-2-yl]benzonitrile IUPAC Name: 4-[4-(1,3-benzodioxol-5-yl)-5-(2-methylsulfanylpyrimidin-4-yl)-1H-imidazol-2-yl]benzonitrile Traditional Name: 4-[4-(1,3-benzodioxol-5-yl)-5-[2-(methylthio)pyrimidin-4-yl]-1H-imidazol-2-yl]benzonitrile Formula: C22H15N5O2S MolecularWeight: 413.4518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)C2=C(N=C(N2)C3=CC=C(C=C3)C#N)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CSC1=NC=CC(=N1)C2=C(N=C(N2)C3=CC=C(C=C3)C#N)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H15N5O2S/c1-30-22-24-9-8-16(25-22)20-19(15-6-7-17-18(10-15)29-12-28-17)26-21(27-20)14-4-2-13(11-23)3-5-14/h2-10H,12H2,1H3,(H,26,27)