2,6-dimethoxy-N-[3-(2-methylpentadecan-2-yl)-1,2-oxazol-5-yl]benzenecarbothioamide

Systemtic Name: 2,6-dimethoxy-N-[3-(2-methylpentadecan-2-yl)-1,2-oxazol-5-yl]benzenecarbothioamide Openeye Name: N-[3-(1,1-dimethyltetradecyl)isoxazol-5-yl]-2,6-dimethoxy-benzenecarbothioamide CAS Name: 2,6-dimethoxy-N-[3-(2-methylpentadecan-2-yl)-5-isoxazolyl]benzenecarbothioamide IUPAC Name: 2,6-dimethoxy-N-[3-(2-methylpentadecan-2-yl)-1,2-oxazol-5-yl]benzenecarbothioamide Traditional Name: N-[3-(1,1-dimethyltetradecyl)isoxazol-5-yl]-2,6-dimethoxy-thiobenzamide Formula: C28H44N2O3S MolecularWeight: 488.72556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C)(C)C1=NOC(=C1)NC(=S)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CCCCCCCCCCCCCC(C)(C)C1=NOC(=C1)NC(=S)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C28H44N2O3S/c1-6-7-8-9-10-11-12-13-14-15-16-20-28(2,3)24-21-25(33-30-24)29-27(34)26-22(31-4)18-17-19-23(26)32-5/h17-19,21H,6-16,20H2,1-5H3,(H,29,34)