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

Systemtic Name: 3-cyclohexyl-2-(2-methylphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-cyclohexyl-2-(o-tolyl)thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-cyclohexyl-2-(2-methylphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-cyclohexyl-2-(2-methylphenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-cyclohexyl-2-(o-tolyl)thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C24H22N2O2S MolecularWeight: 402.50868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2C5CCCCC5

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2C5CCCCC5

InChI

InChI=1S/C24H22N2O2S/c1-15-9-5-6-12-17(15)22-25-23-20(21(27)18-13-7-8-14-19(18)29-23)24(28)26(22)16-10-3-2-4-11-16/h5-9,12-14,16H,2-4,10-11H2,1H3