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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2CCCOC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2CCCOC

InChI

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