3-[[(2E)-4-(2-carbamothioyl-4-methyl-1,3-thiazol-5-yl)-2-diazanylidene-4-oxidanylidene-butanoyl]amino]-4-methyl-N-oxidanyl-benzeneamine oxide

Systemtic Name: 3-[[(2E)-4-(2-carbamothioyl-4-methyl-1,3-thiazol-5-yl)-2-diazanylidene-4-oxidanylidene-butanoyl]amino]-4-methyl-N-oxidanyl-benzeneamine oxide Openeye Name: 3-[[(2E)-4-(2-carbamothioyl-4-methyl-thiazol-5-yl)-2-hydrazinylidene-4-oxo-butanoyl]amino]-N-hydroxy-4-methyl-benzeneamine oxide CAS Name: 3-[[(2E)-4-(2-carbamothioyl-4-methyl-5-thiazolyl)-2-hydrazinylidene-1,4-dioxobutyl]amino]-N-hydroxy-4-methylbenzeneamine oxide IUPAC Name: 3-[[(2E)-4-(2-carbamothioyl-4-methyl-1,3-thiazol-5-yl)-2-hydrazinylidene-4-oxobutanoyl]amino]-N-hydroxy-4-methylbenzeneamine oxide Traditional Name: 3-[[(2E)-2-hydrazono-4-keto-4-(4-methyl-2-thiocarbamoyl-thiazol-5-yl)butanoyl]amino]-N-hydroxy-4-methyl-benzeneamine oxide Formula: C16H18N6O4S2 MolecularWeight: 422.48192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[NH+](O)[O-])NC(=O)C(=NN)CC(=O)C2=C(N=C(S2)C(=S)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)[NH+](O)[O-])NC(=O)/C(=N/N)/CC(=O)C2=C(N=C(S2)C(=S)N)C

InChI

InChI=1S/C16H18N6O4S2/c1-7-3-4-9(22(25)26)5-10(7)20-15(24)11(21-18)6-12(23)13-8(2)19-16(28-13)14(17)27/h3-5,22,25H,6,18H2,1-2H3,(H2,17,27)(H,20,24)/b21-11+