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

Systemtic Name: 3-(3-methoxypropyl)-2-(2-methylphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-(3-methoxypropyl)-2-(o-tolyl)thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-(3-methoxypropyl)-2-(2-methylphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-(3-methoxypropyl)-2-(2-methylphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-(3-methoxypropyl)-2-(o-tolyl)thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2CCCOC

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2CCCOC

InChI

InChI=1S/C22H20N2O3S/c1-14-8-3-4-9-15(14)20-23-21-18(22(26)24(20)12-7-13-27-2)19(25)16-10-5-6-11-17(16)28-21/h3-6,8-11H,7,12-13H2,1-2H3