ethyl 4-azanyl-3-(3-nitrophenyl)-2-sulfanylidene-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-azanyl-3-(3-nitrophenyl)-2-sulfanylidene-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-amino-3-(3-nitrophenyl)-2-thioxo-thiazole-5-carboxylate CAS Name: 4-amino-3-(3-nitrophenyl)-2-sulfanylidene-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-3-(3-nitrophenyl)-2-sulfanylidene-1,3-thiazole-5-carboxylate Traditional Name: 4-amino-3-(3-nitrophenyl)-2-thioxo-4-thiazoline-5-carboxylic acid ethyl ester Formula: C12H11N3O4S2 MolecularWeight: 325.36344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)S1)C2=CC(=CC=C2)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)S1)C2=CC(=CC=C2)[N+](=O)[O-])N

InChI

InChI=1S/C12H11N3O4S2/c1-2-19-11(16)9-10(13)14(12(20)21-9)7-4-3-5-8(6-7)15(17)18/h3-6H,2,13H2,1H3