methyl 4-(4-ethylphenyl)-5-methyl-2-(pyrazin-2-ylcarbonylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-ethylphenyl)-5-methyl-2-(pyrazin-2-ylcarbonylamino)thiophene-3-carboxylate Openeye Name: methyl 4-(4-ethylphenyl)-5-methyl-2-(pyrazine-2-carbonylamino)thiophene-3-carboxylate CAS Name: 4-(4-ethylphenyl)-5-methyl-2-[[oxo(2-pyrazinyl)methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethylphenyl)-5-methyl-2-(pyrazine-2-carbonylamino)thiophene-3-carboxylate Traditional Name: 4-(4-ethylphenyl)-5-methyl-2-(pyrazinoylamino)thiophene-3-carboxylic acid methyl ester Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3=NC=CN=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3=NC=CN=C3)C

InChI

InChI=1S/C20H19N3O3S/c1-4-13-5-7-14(8-6-13)16-12(2)27-19(17(16)20(25)26-3)23-18(24)15-11-21-9-10-22-15/h5-11H,4H2,1-3H3,(H,23,24)