4-[5-(1,3-benzodioxol-5-yl)-1-(6-methylpyridin-2-yl)pyrazol-3-yl]benzenecarbonitrile

Systemtic Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(6-methylpyridin-2-yl)pyrazol-3-yl]benzenecarbonitrile Openeye Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(6-methyl-2-pyridyl)pyrazol-3-yl]benzonitrile CAS Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(6-methyl-2-pyridinyl)-3-pyrazolyl]benzonitrile IUPAC Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(6-methylpyridin-2-yl)pyrazol-3-yl]benzonitrile Traditional Name: 4-[5-(1,3-benzodioxol-5-yl)-1-(6-methyl-2-pyridyl)pyrazol-3-yl]benzonitrile Formula: C23H16N4O2 MolecularWeight: 380.39874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)N2C(=CC(=N2)C3=CC=C(C=C3)C#N)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NC(=CC=C1)N2C(=CC(=N2)C3=CC=C(C=C3)C#N)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H16N4O2/c1-15-3-2-4-23(25-15)27-20(18-9-10-21-22(11-18)29-14-28-21)12-19(26-27)17-7-5-16(13-24)6-8-17/h2-12H,14H2,1H3