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

Systemtic Name: 7-bromanyl-2-(2-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate Openeye Name: 7-bromo-2-(2-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate CAS Name: 7-bromo-2-(2-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidine-4-thiolate IUPAC Name: 7-bromo-2-(2-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate Traditional Name: 7-bromo-2-(2-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate Formula: C18H12BrN2O2S- MolecularWeight: 400.26908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC3=C(CC4=C(O3)C=CC(=C4)Br)C(=N2)[S-]

Isomeric SMILES

COC1=CC=CC=C1C2=NC3=C(CC4=C(O3)C=CC(=C4)Br)C(=N2)[S-]

InChI

InChI=1S/C18H13BrN2O2S/c1-22-15-5-3-2-4-12(15)16-20-17-13(18(24)21-16)9-10-8-11(19)6-7-14(10)23-17/h2-8H,9H2,1H3,(H,20,21,24)/p-1