ethyl 4-methyl-2-[[(2E)-2-[(3-nitrophenyl)hydrazinylidene]-3-oxidanylidene-butanoyl]amino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[(2E)-2-[(3-nitrophenyl)hydrazinylidene]-3-oxidanylidene-butanoyl]amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[(2E)-2-[(3-nitrophenyl)hydrazono]-3-oxo-butanoyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[(2E)-2-[(3-nitrophenyl)hydrazinylidene]-1,3-dioxobutyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[(2E)-2-[(3-nitrophenyl)hydrazinylidene]-3-oxobutanoyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[[(2E)-3-keto-2-[(3-nitrophenyl)hydrazono]butanoyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C17H17N5O6S MolecularWeight: 419.41178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C(=NNC2=CC(=CC=C2)[N+](=O)[O-])C(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)/C(=N/NC2=CC(=CC=C2)[N+](=O)[O-])/C(=O)C)C

InChI

InChI=1S/C17H17N5O6S/c1-4-28-16(25)14-9(2)18-17(29-14)19-15(24)13(10(3)23)21-20-11-6-5-7-12(8-11)22(26)27/h5-8,20H,4H2,1-3H3,(H,18,19,24)/b21-13+