ethyl 4,5-dimethyl-2-[[(2S)-2-(4-nitropyrazol-1-yl)propanoyl]amino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[[(2S)-2-(4-nitropyrazol-1-yl)propanoyl]amino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[(2S)-2-(4-nitropyrazol-1-yl)propanoyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[(2S)-2-(4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[(2S)-2-(4-nitropyrazol-1-yl)propanoyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[(2S)-2-(4-nitropyrazol-1-yl)propanoyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C15H18N4O5S MolecularWeight: 366.39222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C(C)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)[C@H](C)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O5S/c1-5-24-15(21)12-8(2)10(4)25-14(12)17-13(20)9(3)18-7-11(6-16-18)19(22)23/h6-7,9H,5H2,1-4H3,(H,17,20)/t9-/m0/s1