ethyl 4-methyl-2-[2-[(5-nitro-1,3-benzoxazol-2-yl)sulfanyl]ethanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[2-[(5-nitro-1,3-benzoxazol-2-yl)sulfanyl]ethanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[2-[(5-nitro-1,3-benzoxazol-2-yl)sulfanyl]acetyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[2-[(5-nitro-1,3-benzoxazol-2-yl)thio]-1-oxoethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[2-[(5-nitro-1,3-benzoxazol-2-yl)sulfanyl]acetyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[2-[(5-nitro-1,3-benzoxazol-2-yl)thio]acetyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C16H14N4O6S2 MolecularWeight: 422.43556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C16H14N4O6S2/c1-3-25-14(22)13-8(2)17-15(28-13)19-12(21)7-27-16-18-10-6-9(20(23)24)4-5-11(10)26-16/h4-6H,3,7H2,1-2H3,(H,17,19,21)