3-butyl-2-(2-methylphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 3-butyl-2-(2-methylphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-butyl-2-(o-tolyl)thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-butyl-2-(2-methylphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-butyl-2-(2-methylphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-butyl-2-(o-tolyl)thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C22H20N2O2S MolecularWeight: 376.4714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3S2)C4=CC=CC=C4C

Isomeric SMILES

CCCCN1C(=NC2=C(C1=O)C(=O)C3=CC=CC=C3S2)C4=CC=CC=C4C

InChI

InChI=1S/C22H20N2O2S/c1-3-4-13-24-20(15-10-6-5-9-14(15)2)23-21-18(22(24)26)19(25)16-11-7-8-12-17(16)27-21/h5-12H,3-4,13H2,1-2H3