4-[1-(2,4-dichlorophenyl)ethyl]-2-pent-4-ynyl-imidazole-2-carbonitrile

Systemtic Name: 4-[1-(2,4-dichlorophenyl)ethyl]-2-pent-4-ynyl-imidazole-2-carbonitrile Openeye Name: 4-[1-(2,4-dichlorophenyl)ethyl]-2-pent-4-ynyl-imidazole-2-carbonitrile CAS Name: 4-[1-(2,4-dichlorophenyl)ethyl]-2-pent-4-ynyl-2-imidazolecarbonitrile IUPAC Name: 4-[1-(2,4-dichlorophenyl)ethyl]-2-pent-4-ynylimidazole-2-carbonitrile Traditional Name: 4-[1-(2,4-dichlorophenyl)ethyl]-2-pent-4-ynyl-imidazole-2-carbonitrile Formula: C17H15Cl2N3 MolecularWeight: 332.2271

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)Cl)Cl)C2=NC(N=C2)(CCCC#C)C#N

Isomeric SMILES

CC(C1=C(C=C(C=C1)Cl)Cl)C2=NC(N=C2)(CCCC#C)C#N

InChI

InChI=1S/C17H15Cl2N3/c1-3-4-5-8-17(11-20)21-10-16(22-17)12(2)14-7-6-13(18)9-15(14)19/h1,6-7,9-10,12H,4-5,8H2,2H3