ethyl 5-benzamido-6-oxidanylidene-2-[(E)-2-(pyrazin-2-ylamino)ethenyl]pyran-3-carboxylate

Systemtic Name: ethyl 5-benzamido-6-oxidanylidene-2-[(E)-2-(pyrazin-2-ylamino)ethenyl]pyran-3-carboxylate Openeye Name: ethyl 5-benzamido-6-oxo-2-[(E)-2-(pyrazin-2-ylamino)vinyl]pyran-3-carboxylate CAS Name: 5-benzamido-6-oxo-2-[(E)-2-(2-pyrazinylamino)ethenyl]-3-pyrancarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzamido-6-oxo-2-[(E)-2-(pyrazin-2-ylamino)ethenyl]pyran-3-carboxylate Traditional Name: 5-benzamido-6-keto-2-[(E)-2-(pyrazin-2-ylamino)vinyl]pyran-3-carboxylic acid ethyl ester Formula: C21H18N4O5 MolecularWeight: 406.39142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=O)C(=C1)NC(=O)C2=CC=CC=C2)C=CNC3=NC=CN=C3

Isomeric SMILES

CCOC(=O)C1=C(OC(=O)C(=C1)NC(=O)C2=CC=CC=C2)/C=C/NC3=NC=CN=C3

InChI

InChI=1S/C21H18N4O5/c1-2-29-20(27)15-12-16(25-19(26)14-6-4-3-5-7-14)21(28)30-17(15)8-9-23-18-13-22-10-11-24-18/h3-13H,2H2,1H3,(H,23,24)(H,25,26)/b9-8+