2-(2,4-dimethylphenoxy)-N-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]hexanamide

Systemtic Name: 2-(2,4-dimethylphenoxy)-N-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]hexanamide Openeye Name: 2-(2,4-dimethylphenoxy)-N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]hexanamide CAS Name: 2-(2,4-dimethylphenoxy)-N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]hexanamide IUPAC Name: 2-(2,4-dimethylphenoxy)-N-[3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]hexanamide Traditional Name: 2-(2,4-dimethylphenoxy)-N-[3-(5-thioxo-2H-tetrazol-1-yl)phenyl]hexanamide Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=CC=CC(=C1)N2C(=S)N=NN2)OC3=C(C=C(C=C3)C)C

Isomeric SMILES

CCCCC(C(=O)NC1=CC=CC(=C1)N2C(=S)N=NN2)OC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C21H25N5O2S/c1-4-5-9-19(28-18-11-10-14(2)12-15(18)3)20(27)22-16-7-6-8-17(13-16)26-21(29)23-24-25-26/h6-8,10-13,19H,4-5,9H2,1-3H3,(H,22,27)(H,23,25,29)