[1-(1,3-benzothiazol-2-ylamino)-1-oxidanylidene-butan-2-yl] pyrazine-2-carboxylate

Systemtic Name: [1-(1,3-benzothiazol-2-ylamino)-1-oxidanylidene-butan-2-yl] pyrazine-2-carboxylate Openeye Name: 1-(1,3-benzothiazol-2-ylcarbamoyl)propyl pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [1-(1,3-benzothiazol-2-ylamino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(1,3-benzothiazol-2-ylamino)-1-oxobutan-2-yl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid 1-(1,3-benzothiazol-2-ylcarbamoyl)propyl ester Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=CC=CC=C2S1)OC(=O)C3=NC=CN=C3

Isomeric SMILES

CCC(C(=O)NC1=NC2=CC=CC=C2S1)OC(=O)C3=NC=CN=C3

InChI

InChI=1S/C16H14N4O3S/c1-2-12(23-15(22)11-9-17-7-8-18-11)14(21)20-16-19-10-5-3-4-6-13(10)24-16/h3-9,12H,2H2,1H3,(H,19,20,21)