phenyl N-[[6-(trifluoromethyl)-2H-1,4-benzoxazin-3-yl]sulfanylmethyl]carbamate

Systemtic Name: phenyl N-[[6-(trifluoromethyl)-2H-1,4-benzoxazin-3-yl]sulfanylmethyl]carbamate Openeye Name: phenyl N-[[6-(trifluoromethyl)-2H-1,4-benzoxazin-3-yl]sulfanylmethyl]carbamate CAS Name: N-[[[6-(trifluoromethyl)-2H-1,4-benzoxazin-3-yl]thio]methyl]carbamic acid phenyl ester IUPAC Name: phenyl N-[[6-(trifluoromethyl)-2H-1,4-benzoxazin-3-yl]sulfanylmethyl]carbamate Traditional Name: N-[[[6-(trifluoromethyl)-2H-1,4-benzoxazin-3-yl]thio]methyl]carbamic acid phenyl ester Formula: C17H13F3N2O3S MolecularWeight: 382.35693

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(O1)C=CC(=C2)C(F)(F)F)SCNC(=O)OC3=CC=CC=C3

Isomeric SMILES

C1C(=NC2=C(O1)C=CC(=C2)C(F)(F)F)SCNC(=O)OC3=CC=CC=C3

InChI

InChI=1S/C17H13F3N2O3S/c18-17(19,20)11-6-7-14-13(8-11)22-15(9-24-14)26-10-21-16(23)25-12-4-2-1-3-5-12/h1-8H,9-10H2,(H,21,23)