2-bromanyl-6-methoxy-N-[3-(3-methylhexan-3-yl)-1,2-oxazol-5-yl]benzenecarbothioamide

Systemtic Name: 2-bromanyl-6-methoxy-N-[3-(3-methylhexan-3-yl)-1,2-oxazol-5-yl]benzenecarbothioamide Openeye Name: 2-bromo-N-[3-(1-ethyl-1-methyl-butyl)isoxazol-5-yl]-6-methoxy-benzenecarbothioamide CAS Name: 2-bromo-6-methoxy-N-[3-(3-methylhexan-3-yl)-5-isoxazolyl]benzenecarbothioamide IUPAC Name: 2-bromo-6-methoxy-N-[3-(3-methylhexan-3-yl)-1,2-oxazol-5-yl]benzenecarbothioamide Traditional Name: 2-bromo-N-[3-(1-ethyl-1-methyl-butyl)isoxazol-5-yl]-6-methoxy-thiobenzamide Formula: C18H23BrN2O2S MolecularWeight: 411.35642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(CC)C1=NOC(=C1)NC(=S)C2=C(C=CC=C2Br)OC

Isomeric SMILES

CCCC(C)(CC)C1=NOC(=C1)NC(=S)C2=C(C=CC=C2Br)OC

InChI

InChI=1S/C18H23BrN2O2S/c1-5-10-18(3,6-2)14-11-15(23-21-14)20-17(24)16-12(19)8-7-9-13(16)22-4/h7-9,11H,5-6,10H2,1-4H3,(H,20,24)