2-[2-cyano-2-(4-ethylsulfonylphenyl)hexyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 2-[2-cyano-2-(4-ethylsulfonylphenyl)hexyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 2-[2-cyano-2-(4-ethylsulfonylphenyl)hexyl]-1,2,4-triazole-3-carbonitrile CAS Name: 2-[2-cyano-2-(4-ethylsulfonylphenyl)hexyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 2-[2-cyano-2-(4-ethylsulfonylphenyl)hexyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 2-[2-cyano-2-(4-esylphenyl)hexyl]-1,2,4-triazole-3-carbonitrile Formula: C18H21N5O2S MolecularWeight: 371.45664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CN1C(=NC=N1)C#N)(C#N)C2=CC=C(C=C2)S(=O)(=O)CC

Isomeric SMILES

CCCCC(CN1C(=NC=N1)C#N)(C#N)C2=CC=C(C=C2)S(=O)(=O)CC

InChI

InChI=1S/C18H21N5O2S/c1-3-5-10-18(12-20,13-23-17(11-19)21-14-22-23)15-6-8-16(9-7-15)26(24,25)4-2/h6-9,14H,3-5,10,13H2,1-2H3