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

Systemtic Name: 3-[(3-aminocarbonyl-5-methoxycarbonyl-4-methyl-thiophen-2-yl)carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[(3-carbamoyl-5-methoxycarbonyl-4-methyl-2-thienyl)carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[[(3-carbamoyl-5-methoxycarbonyl-4-methyl-2-thiophenyl)amino]-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[(3-carbamoyl-5-methoxycarbonyl-4-methylthiophen-2-yl)carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[(3-carbamoyl-5-carbomethoxy-4-methyl-2-thienyl)carbamoyl]pyrazinoic acid Formula: C14H12N4O6S MolecularWeight: 364.33328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2=NC=CN=C2C(=O)O)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C2=NC=CN=C2C(=O)O)C(=O)OC

InChI

InChI=1S/C14H12N4O6S/c1-5-6(10(15)19)12(25-9(5)14(23)24-2)18-11(20)7-8(13(21)22)17-4-3-16-7/h3-4H,1-2H3,(H2,15,19)(H,18,20)(H,21,22)