ethyl 2-[2-(6-chloranylbenzotriazol-1-yl)oxyethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(6-chloranylbenzotriazol-1-yl)oxyethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(6-chlorobenzotriazol-1-yl)oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(6-chloro-1-benzotriazolyl)oxy]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(6-chlorobenzotriazol-1-yl)oxyacetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-(6-chlorobenzotriazol-1-yl)oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H17ClN4O4S MolecularWeight: 408.85928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CON2C3=C(C=CC(=C3)Cl)N=N2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CON2C3=C(C=CC(=C3)Cl)N=N2

InChI

InChI=1S/C17H17ClN4O4S/c1-4-25-17(24)15-9(2)10(3)27-16(15)19-14(23)8-26-22-13-7-11(18)5-6-12(13)20-21-22/h5-7H,4,8H2,1-3H3,(H,19,23)