N,2-dimethyl-6-nitro-2-(trifluoromethyl)chromene-4-carbothioamide

Systemtic Name: N,2-dimethyl-6-nitro-2-(trifluoromethyl)chromene-4-carbothioamide Openeye Name: N,2-dimethyl-6-nitro-2-(trifluoromethyl)chromene-4-carbothioamide CAS Name: N,2-dimethyl-6-nitro-2-(trifluoromethyl)-1-benzopyran-4-carbothioamide IUPAC Name: N,2-dimethyl-6-nitro-2-(trifluoromethyl)chromene-4-carbothioamide Traditional Name: N,2-dimethyl-6-nitro-2-(trifluoromethyl)chromene-4-carbothioamide Formula: C13H11F3N2O3S MolecularWeight: 332.29825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])C(=S)NC)C(F)(F)F

Isomeric SMILES

CC1(C=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])C(=S)NC)C(F)(F)F

InChI

InChI=1S/C13H11F3N2O3S/c1-12(13(14,15)16)6-9(11(22)17-2)8-5-7(18(19)20)3-4-10(8)21-12/h3-6H,1-2H3,(H,17,22)