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

Systemtic Name: 7-tert-butyl-2-(4-methoxyphenyl)-9-oxidanyl-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione Openeye Name: 7-tert-butyl-9-hydroxy-2-(4-methoxyphenyl)-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione CAS Name: 7-tert-butyl-9-hydroxy-2-(4-methoxyphenyl)-1,5-dihydro[1]benzopyrano[2,3-d]pyrimidine-4-thione IUPAC Name: 7-tert-butyl-9-hydroxy-2-(4-methoxyphenyl)-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione Traditional Name: 7-tert-butyl-9-hydroxy-2-(4-methoxyphenyl)-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O3S/c1-22(2,3)14-9-13-10-16-20(27-18(13)17(25)11-14)23-19(24-21(16)28)12-5-7-15(26-4)8-6-12/h5-9,11,25H,10H2,1-4H3,(H,23,24,28)