ethyl 2-azanyl-4-(4-chloranyl-3-nitro-phenyl)-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-azanyl-4-(4-chloranyl-3-nitro-phenyl)-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-amino-4-(4-chloro-3-nitro-phenyl)thiazole-5-carboxylate CAS Name: 2-amino-4-(4-chloro-3-nitrophenyl)-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(4-chloro-3-nitrophenyl)-1,3-thiazole-5-carboxylate Traditional Name: 2-amino-4-(4-chloro-3-nitro-phenyl)thiazole-5-carboxylic acid ethyl ester Formula: C12H10ClN3O4S MolecularWeight: 327.7435

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10ClN3O4S/c1-2-20-11(17)10-9(15-12(14)21-10)6-3-4-7(13)8(5-6)16(18)19/h3-5H,2H2,1H3,(H2,14,15)