2-(4-methoxyphenyl)-3-(2-methylpropyl)thiochromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 2-(4-methoxyphenyl)-3-(2-methylpropyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-isobutyl-2-(4-methoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 2-(4-methoxyphenyl)-3-(2-methylpropyl)thiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 2-(4-methoxyphenyl)-3-(2-methylpropyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-isobutyl-2-(4-methoxyphenyl)thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3S2)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)CN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3S2)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H20N2O3S/c1-13(2)12-24-20(14-8-10-15(27-3)11-9-14)23-21-18(22(24)26)19(25)16-6-4-5-7-17(16)28-21/h4-11,13H,12H2,1-3H3