ethyl 6-azanylidene-3-(4-nitrophenyl)-5-(phenylcarbonyl)pyrazolo[5,1-b][1,3]thiazole-7-carboxylate

Systemtic Name: ethyl 6-azanylidene-3-(4-nitrophenyl)-5-(phenylcarbonyl)pyrazolo[5,1-b][1,3]thiazole-7-carboxylate Openeye Name: ethyl 5-benzoyl-6-imino-3-(4-nitrophenyl)pyrazolo[5,1-b]thiazole-7-carboxylate CAS Name: 5-benzoyl-6-imino-3-(4-nitrophenyl)-7-pyrazolo[5,1-b]thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzoyl-6-imino-3-(4-nitrophenyl)pyrazolo[5,1-b][1,3]thiazole-7-carboxylate Traditional Name: 5-benzoyl-6-imino-3-(4-nitrophenyl)pyrazolo[5,1-b]thiazole-7-carboxylic acid ethyl ester Formula: C21H16N4O5S MolecularWeight: 436.44054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2N(C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-])N(C1=N)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C2N(C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-])N(C1=N)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H16N4O5S/c1-2-30-21(27)17-18(22)24(19(26)14-6-4-3-5-7-14)23-16(12-31-20(17)23)13-8-10-15(11-9-13)25(28)29/h3-12,22H,2H2,1H3