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

Systemtic Name: ethyl 2-[2-[2-(5-methyl-3-nitro-pyrazol-1-yl)butanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(5-methyl-3-nitro-pyrazol-1-yl)butanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-(5-methyl-3-nitro-1-pyrazolyl)-1-oxobutyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(5-methyl-3-nitropyrazol-1-yl)butanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[2-(5-methyl-3-nitro-pyrazol-1-yl)butanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C15H19N5O5S MolecularWeight: 381.40686

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=CS1)CC(=O)OCC)N2C(=CC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NC1=NC(=CS1)CC(=O)OCC)N2C(=CC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C15H19N5O5S/c1-4-11(19-9(3)6-12(18-19)20(23)24)14(22)17-15-16-10(8-26-15)7-13(21)25-5-2/h6,8,11H,4-5,7H2,1-3H3,(H,16,17,22)