7-bromanyl-9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate

Systemtic Name: 7-bromanyl-9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate Openeye Name: 7-bromo-9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate CAS Name: 7-bromo-9-methoxy-2-phenyl-5H-[1]benzopyrano[2,3-d]pyrimidine-4-thiolate IUPAC Name: 7-bromo-9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate Traditional Name: 7-bromo-9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate Formula: C18H12BrN2O2S- MolecularWeight: 400.26908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)Br)CC3=C(O2)N=C(N=C3[S-])C4=CC=CC=C4

Isomeric SMILES

COC1=C2C(=CC(=C1)Br)CC3=C(O2)N=C(N=C3[S-])C4=CC=CC=C4

InChI

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