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

Systemtic Name: 2-azanyl-4-(1,3-benzodioxol-5-yl)-5-methyl-6-(4-methylphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-4-(1,3-benzodioxol-5-yl)-5-methyl-6-(p-tolyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-(1,3-benzodioxol-5-yl)-5-methyl-6-(4-methylphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(1,3-benzodioxol-5-yl)-5-methyl-6-(4-methylphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-4-(1,3-benzodioxol-5-yl)-5-methyl-6-(p-tolyl)nicotinonitrile Formula: C21H17N3O2 MolecularWeight: 343.37858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C(C(=N2)N)C#N)C3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C(C(=N2)N)C#N)C3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H17N3O2/c1-12-3-5-14(6-4-12)20-13(2)19(16(10-22)21(23)24-20)15-7-8-17-18(9-15)26-11-25-17/h3-9H,11H2,1-2H3,(H2,23,24)