ethyl 2-[2-[3-(3-nitropyrazol-1-yl)propanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[3-(3-nitropyrazol-1-yl)propanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[3-(3-nitropyrazol-1-yl)propanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[3-(3-nitro-1-pyrazolyl)-1-oxopropyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-(3-nitropyrazol-1-yl)propanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[3-(3-nitropyrazol-1-yl)propanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C13H15N5O5S MolecularWeight: 353.3537

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)CCN2C=CC(=N2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)CCN2C=CC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O5S/c1-2-23-12(20)7-9-8-24-13(14-9)15-11(19)4-6-17-5-3-10(16-17)18(21)22/h3,5,8H,2,4,6-7H2,1H3,(H,14,15,19)