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

Systemtic Name: 2-cyclohexyl-3-(furan-2-ylmethyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 2-cyclohexyl-3-(2-furylmethyl)thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 2-cyclohexyl-3-(2-furanylmethyl)thiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 2-cyclohexyl-3-(furan-2-ylmethyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 2-cyclohexyl-3-(2-furfuryl)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:

C1CCC(CC1)C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2CC5=CC=CO5

Isomeric SMILES

C1CCC(CC1)C2=NC3=C(C(=O)C4=CC=CC=C4S3)C(=O)N2CC5=CC=CO5

InChI

InChI=1S/C22H20N2O3S/c25-19-16-10-4-5-11-17(16)28-21-18(19)22(26)24(13-15-9-6-12-27-15)20(23-21)14-7-2-1-3-8-14/h4-6,9-12,14H,1-3,7-8,13H2