ethyl 2-[2-[2-(4-nitrophenyl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(4-nitrophenyl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(4-nitrophenyl)sulfanylpropanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-[(4-nitrophenyl)thio]-1-oxopropyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(4-nitrophenyl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[2-[(4-nitrophenyl)thio]propanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C16H17N3O5S2 MolecularWeight: 395.45328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O5S2/c1-3-24-14(20)8-11-9-25-16(17-11)18-15(21)10(2)26-13-6-4-12(5-7-13)19(22)23/h4-7,9-10H,3,8H2,1-2H3,(H,17,18,21)