4-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 4-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 4-[2-(4-cyclohexylphenyl)-2-oxo-ethyl]-1,2,4-triazole-3-carbonitrile CAS Name: 4-[2-(4-cyclohexylphenyl)-2-oxoethyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 4-[2-(4-cyclohexylphenyl)-2-oxoethyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 4-[2-(4-cyclohexylphenyl)-2-keto-ethyl]-1,2,4-triazole-3-carbonitrile Formula: C17H18N4O MolecularWeight: 294.35102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)CN3C=NN=C3C#N

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)CN3C=NN=C3C#N

InChI

InChI=1S/C17H18N4O/c18-10-17-20-19-12-21(17)11-16(22)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h6-9,12-13H,1-5,11H2