ethyl 3-(pyrazin-2-ylcarbonylamino)-5-(3,4,5-trimethoxyphenyl)thiophene-2-carboxylate

Systemtic Name: ethyl 3-(pyrazin-2-ylcarbonylamino)-5-(3,4,5-trimethoxyphenyl)thiophene-2-carboxylate Openeye Name: ethyl 3-(pyrazine-2-carbonylamino)-5-(3,4,5-trimethoxyphenyl)thiophene-2-carboxylate CAS Name: 3-[[oxo(2-pyrazinyl)methyl]amino]-5-(3,4,5-trimethoxyphenyl)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(pyrazine-2-carbonylamino)-5-(3,4,5-trimethoxyphenyl)thiophene-2-carboxylate Traditional Name: 3-(pyrazinoylamino)-5-(3,4,5-trimethoxyphenyl)thiophene-2-carboxylic acid ethyl ester Formula: C21H21N3O6S MolecularWeight: 443.47294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC(=C(C(=C2)OC)OC)OC)NC(=O)C3=NC=CN=C3

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC(=C(C(=C2)OC)OC)OC)NC(=O)C3=NC=CN=C3

InChI

InChI=1S/C21H21N3O6S/c1-5-30-21(26)19-13(24-20(25)14-11-22-6-7-23-14)10-17(31-19)12-8-15(27-2)18(29-4)16(9-12)28-3/h6-11H,5H2,1-4H3,(H,24,25)