2,6-diethoxy-N-[3-(3-ethylhex-5-en-3-yl)-1,2-oxazol-5-yl]benzenecarbothioamide

Systemtic Name: 2,6-diethoxy-N-[3-(3-ethylhex-5-en-3-yl)-1,2-oxazol-5-yl]benzenecarbothioamide Openeye Name: N-[3-(1,1-diethylbut-3-enyl)isoxazol-5-yl]-2,6-diethoxy-benzenecarbothioamide CAS Name: 2,6-diethoxy-N-[3-(3-ethylhex-5-en-3-yl)-5-isoxazolyl]benzenecarbothioamide IUPAC Name: 2,6-diethoxy-N-[3-(3-ethylhex-5-en-3-yl)-1,2-oxazol-5-yl]benzenecarbothioamide Traditional Name: N-[3-(1,1-diethylbut-3-enyl)isoxazol-5-yl]-2,6-diethoxy-thiobenzamide Formula: C22H30N2O3S MolecularWeight: 402.5502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC=C)C1=NOC(=C1)NC(=S)C2=C(C=CC=C2OCC)OCC

Isomeric SMILES

CCC(CC)(CC=C)C1=NOC(=C1)NC(=S)C2=C(C=CC=C2OCC)OCC

InChI

InChI=1S/C22H30N2O3S/c1-6-14-22(7-2,8-3)18-15-19(27-24-18)23-21(28)20-16(25-9-4)12-11-13-17(20)26-10-5/h6,11-13,15H,1,7-10,14H2,2-5H3,(H,23,28)