ethyl 2-[2-[2-(5-methyl-3,4-dinitro-pyrazol-1-yl)ethanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(5-methyl-3,4-dinitro-pyrazol-1-yl)ethanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-(5-methyl-3,4-dinitro-1-pyrazolyl)-1-oxoethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[2-(5-methyl-3,4-dinitropyrazol-1-yl)acetyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[2-(5-methyl-3,4-dinitro-pyrazol-1-yl)acetyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C13H14N6O7S MolecularWeight: 398.35126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)CN2C(=C(C(=N2)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)CN2C(=C(C(=N2)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C13H14N6O7S/c1-3-26-10(21)4-8-6-27-13(14-8)15-9(20)5-17-7(2)11(18(22)23)12(16-17)19(24)25/h6H,3-5H2,1-2H3,(H,14,15,20)