ethyl 5-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[4-(3-nitrophenyl)thiazol-2-yl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[4-(3-nitrophenyl)-2-thiazolyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[4-(3-nitrophenyl)thiazol-2-yl]pyrazole-4-carboxylic acid ethyl ester Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C16H14N4O4S/c1-3-24-15(21)13-8-17-19(10(13)2)16-18-14(9-25-16)11-5-4-6-12(7-11)20(22)23/h4-9H,3H2,1-2H3