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7-bromanyl-2-(3,4,5-trimethoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate

7-bromanyl-2-(3,4,5-trimethoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate

Systemtic Name:7-bromanyl-2-(3,4,5-trimethoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate
Openeye Name:7-bromo-2-(3,4,5-trimethoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate
CAS Name:7-bromo-2-(3,4,5-trimethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidine-4-thiolate
IUPAC Name:7-bromo-2-(3,4,5-trimethoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate
Traditional Name:7-bromo-2-(3,4,5-trimethoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate
Formula: C20H16BrN2O4S-
MolecularWeight: 460.32104
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=C(CC4=C(O3)C=CC(=C4)Br)C(=N2)[S-]


Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=C(CC4=C(O3)C=CC(=C4)Br)C(=N2)[S-]


InChI

InChI=1S/C20H17BrN2O4S/c1-24-15-8-11(9-16(25-2)17(15)26-3)18-22-19-13(20(28)23-18)7-10-6-12(21)4-5-14(10)27-19/h4-6,8-9H,7H2,1-3H3,(H,22,23,28)/p-1


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