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4-methyl-N-[(E)-1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-ylideneamino]-3-nitro-benzenesulfonamide
4-methyl-N-[(E)-1-[5-(methylamino)-1,2,4-thiadiazol-3-yl]propan-2-ylideneamino]-3-nitro-benzenesulfonamide
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Descriptors Computed from Structure
Canonical SMILES:
CC1=C(C=C(C=C1)S(=O)(=O)NN=C(C)CC2=NSC(=N2)NC)[N+](=O)[O-]
Isomeric SMILES
CC1=C(C=C(C=C1)S(=O)(=O)N/N=C(\C)/CC2=NSC(=N2)NC)[N+](=O)[O-]
InChI
InChI=1S/C13H16N6O4S2/c1-8-4-5-10(7-11(8)19(20)21)25(22,23)18-16-9(2)6-12-15-13(14-3)24-17-12/h4-5,7,18H,6H2,1-3H3,(H,14,15,17)/b16-9+
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