ethyl 5,5-dimethyl-2-[(pyridin-4-ylcarbonylamino)carbamoylamino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate

Systemtic Name: ethyl 5,5-dimethyl-2-[(pyridin-4-ylcarbonylamino)carbamoylamino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate Openeye Name: ethyl 5,5-dimethyl-2-[(pyridine-4-carbonylamino)carbamoylamino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate CAS Name: 5,5-dimethyl-2-[[oxo-[[oxo(pyridin-4-yl)methyl]hydrazo]methyl]amino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5,5-dimethyl-2-[(pyridine-4-carbonylamino)carbamoylamino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate Traditional Name: 2-(isonicotinamidocarbamoylamino)-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid ethyl ester Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=O)NNC(=O)C3=CC=NC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=O)NNC(=O)C3=CC=NC=C3

InChI

InChI=1S/C19H22N4O5S/c1-4-27-17(25)14-12-9-19(2,3)28-10-13(12)29-16(14)21-18(26)23-22-15(24)11-5-7-20-8-6-11/h5-8H,4,9-10H2,1-3H3,(H,22,24)(H2,21,23,26)