2-azanyl-6-(2,4-dichlorophenyl)-4-(4-heptoxyphenyl)-5-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-6-(2,4-dichlorophenyl)-4-(4-heptoxyphenyl)-5-methyl-pyridine-3-carbonitrile Openeye Name: 2-amino-6-(2,4-dichlorophenyl)-4-(4-heptoxyphenyl)-5-methyl-pyridine-3-carbonitrile CAS Name: 2-amino-6-(2,4-dichlorophenyl)-4-(4-heptoxyphenyl)-5-methyl-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-(2,4-dichlorophenyl)-4-(4-heptoxyphenyl)-5-methylpyridine-3-carbonitrile Traditional Name: 2-amino-6-(2,4-dichlorophenyl)-4-(4-heptoxyphenyl)-5-methyl-nicotinonitrile Formula: C26H27Cl2N3O MolecularWeight: 468.41808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=C(C(=NC(=C2C)C3=C(C=C(C=C3)Cl)Cl)N)C#N

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=C(C(=NC(=C2C)C3=C(C=C(C=C3)Cl)Cl)N)C#N

InChI

InChI=1S/C26H27Cl2N3O/c1-3-4-5-6-7-14-32-20-11-8-18(9-12-20)24-17(2)25(31-26(30)22(24)16-29)21-13-10-19(27)15-23(21)28/h8-13,15H,3-7,14H2,1-2H3,(H2,30,31)