7-tert-butyl-9-oxidanyl-2-phenyl-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione

Systemtic Name: 7-tert-butyl-9-oxidanyl-2-phenyl-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione Openeye Name: 7-tert-butyl-9-hydroxy-2-phenyl-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione CAS Name: 7-tert-butyl-9-hydroxy-2-phenyl-1,5-dihydro[1]benzopyrano[2,3-d]pyrimidine-4-thione IUPAC Name: 7-tert-butyl-9-hydroxy-2-phenyl-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione Traditional Name: 7-tert-butyl-9-hydroxy-2-phenyl-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione Formula: C21H20N2O2S MolecularWeight: 364.4607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)CC3=C(O2)NC(=NC3=S)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)CC3=C(O2)NC(=NC3=S)C4=CC=CC=C4)O

InChI

InChI=1S/C21H20N2O2S/c1-21(2,3)14-9-13-10-15-19(25-17(13)16(24)11-14)22-18(23-20(15)26)12-7-5-4-6-8-12/h4-9,11,24H,10H2,1-3H3,(H,22,23,26)