1-methyl-1-[2-[3-oxidanylidene-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]ethanoylamino]thiourea

Systemtic Name: 1-methyl-1-[2-[3-oxidanylidene-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]ethanoylamino]thiourea Openeye Name: 1-methyl-1-[[2-[3-oxo-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]acetyl]amino]thiourea CAS Name: 1-methyl-1-[[1-oxo-2-[3-oxo-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]ethyl]amino]thiourea IUPAC Name: 1-methyl-1-[[2-[3-oxo-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]acetyl]amino]thiourea Traditional Name: 1-[[2-[3-keto-6-(trifluoromethyl)-1,4-benzothiazin-4-yl]acetyl]amino]-1-methyl-thiourea Formula: C13H13F3N4O2S2 MolecularWeight: 378.39313

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)N)NC(=O)CN1C(=O)CSC2=C1C=C(C=C2)C(F)(F)F

Isomeric SMILES

CN(C(=S)N)NC(=O)CN1C(=O)CSC2=C1C=C(C=C2)C(F)(F)F

InChI

InChI=1S/C13H13F3N4O2S2/c1-19(12(17)23)18-10(21)5-20-8-4-7(13(14,15)16)2-3-9(8)24-6-11(20)22/h2-4H,5-6H2,1H3,(H2,17,23)(H,18,21)