ethyl 5-(4-chloranylphenoxy)-3-thiophen-2-yl-1,2,4-triazine-6-carboxylate

Systemtic Name: ethyl 5-(4-chloranylphenoxy)-3-thiophen-2-yl-1,2,4-triazine-6-carboxylate Openeye Name: ethyl 5-(4-chlorophenoxy)-3-(2-thienyl)-1,2,4-triazine-6-carboxylate CAS Name: 5-(4-chlorophenoxy)-3-thiophen-2-yl-1,2,4-triazine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-chlorophenoxy)-3-thiophen-2-yl-1,2,4-triazine-6-carboxylate Traditional Name: 5-(4-chlorophenoxy)-3-(2-thienyl)-1,2,4-triazine-6-carboxylic acid ethyl ester Formula: C16H12ClN3O3S MolecularWeight: 361.80278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=N1)C2=CC=CS2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=N1)C2=CC=CS2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H12ClN3O3S/c1-2-22-16(21)13-15(23-11-7-5-10(17)6-8-11)18-14(20-19-13)12-4-3-9-24-12/h3-9H,2H2,1H3