[(4S)-5-ethoxycarbonyl-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl 1H-indazole-3-carboxylate

Systemtic Name: [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl 1H-indazole-3-carboxylate Openeye Name: [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl 1H-indazole-3-carboxylate CAS Name: 1H-indazole-3-carboxylic acid [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl ester IUPAC Name: [(4S)-5-ethoxycarbonyl-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl 1H-indazole-3-carboxylate Traditional Name: 1H-indazole-3-carboxylic acid [(4S)-5-carbethoxy-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidin-6-yl]methyl ester Formula: C18H20N4O5 MolecularWeight: 372.3752

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)C2=NNC3=CC=CC=C32)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)C2=NNC3=CC=CC=C32)C(=O)OCC

InChI

InChI=1S/C18H20N4O5/c1-3-11-14(16(23)26-4-2)13(20-18(25)19-11)9-27-17(24)15-10-7-5-6-8-12(10)21-22-15/h5-8,11H,3-4,9H2,1-2H3,(H,21,22)(H2,19,20,25)/t11-/m0/s1