3-chloranyl-4-(2-ethyl-3-pentan-3-yl-imidazo[4,5-b]pyridin-7-yl)benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-(2-ethyl-3-pentan-3-yl-imidazo[4,5-b]pyridin-7-yl)benzenecarbonitrile Openeye Name: 3-chloro-4-[2-ethyl-3-(1-ethylpropyl)imidazo[4,5-b]pyridin-7-yl]benzonitrile CAS Name: 3-chloro-4-(2-ethyl-3-pentan-3-yl-7-imidazo[4,5-b]pyridinyl)benzonitrile IUPAC Name: 3-chloro-4-(2-ethyl-3-pentan-3-ylimidazo[4,5-b]pyridin-7-yl)benzonitrile Traditional Name: 3-chloro-4-[2-ethyl-3-(1-ethylpropyl)imidazo[4,5-b]pyridin-7-yl]benzonitrile Formula: C20H21ClN4 MolecularWeight: 352.86054

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CN=C2N1C(CC)CC)C3=C(C=C(C=C3)C#N)Cl

Isomeric SMILES

CCC1=NC2=C(C=CN=C2N1C(CC)CC)C3=C(C=C(C=C3)C#N)Cl

InChI

InChI=1S/C20H21ClN4/c1-4-14(5-2)25-18(6-3)24-19-16(9-10-23-20(19)25)15-8-7-13(12-22)11-17(15)21/h7-11,14H,4-6H2,1-3H3