ethyl 2-[2-(2-cyano-4-nitro-phenyl)sulfanyl-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-(2-cyano-4-nitro-phenyl)sulfanyl-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-(2-cyano-4-nitro-phenyl)sulfanylthiazol-4-yl]acetate CAS Name: 2-[2-[(2-cyano-4-nitrophenyl)thio]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-cyano-4-nitrophenyl)sulfanyl-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(2-cyano-4-nitro-phenyl)thio]thiazol-4-yl]acetic acid ethyl ester Formula: C14H11N3O4S2 MolecularWeight: 349.38484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)SC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)SC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C14H11N3O4S2/c1-2-21-13(18)6-10-8-22-14(16-10)23-12-4-3-11(17(19)20)5-9(12)7-15/h3-5,8H,2,6H2,1H3