3-[(5-ethanoyl-3-ethoxycarbonyl-4-methyl-thiophen-2-yl)carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[(5-ethanoyl-3-ethoxycarbonyl-4-methyl-thiophen-2-yl)carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[(5-acetyl-3-ethoxycarbonyl-4-methyl-2-thienyl)carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[[(5-acetyl-3-ethoxycarbonyl-4-methyl-2-thiophenyl)amino]-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[(5-acetyl-3-ethoxycarbonyl-4-methylthiophen-2-yl)carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[(5-acetyl-3-carbethoxy-4-methyl-2-thienyl)carbamoyl]pyrazinoic acid Formula: C16H15N3O6S MolecularWeight: 377.3718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=NC=CN=C2C(=O)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=NC=CN=C2C(=O)O

InChI

InChI=1S/C16H15N3O6S/c1-4-25-16(24)9-7(2)12(8(3)20)26-14(9)19-13(21)10-11(15(22)23)18-6-5-17-10/h5-6H,4H2,1-3H3,(H,19,21)(H,22,23)