[1-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-butan-2-yl] pyrazine-2-carboxylate

Systemtic Name: [1-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-butan-2-yl] pyrazine-2-carboxylate Openeye Name: 1-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]propyl pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [1-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1-oxobutan-2-yl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid 1-[(6-methoxy-1,3-benzothiazol-2-yl)carbamoyl]propyl ester Formula: C17H16N4O4S MolecularWeight: 372.39834

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)OC(=O)C3=NC=CN=C3

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)OC(=O)C3=NC=CN=C3

InChI

InChI=1S/C17H16N4O4S/c1-3-13(25-16(23)12-9-18-6-7-19-12)15(22)21-17-20-11-5-4-10(24-2)8-14(11)26-17/h4-9,13H,3H2,1-2H3,(H,20,21,22)