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

Systemtic Name: 7-methyl-2-(2,3,4-trimethoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate Openeye Name: 7-methyl-2-(2,3,4-trimethoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate CAS Name: 7-methyl-2-(2,3,4-trimethoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidine-4-thiolate IUPAC Name: 7-methyl-2-(2,3,4-trimethoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate Traditional Name: 7-methyl-2-(2,3,4-trimethoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate Formula: C21H19N2O4S- MolecularWeight: 395.45156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C2)C(=NC(=N3)C4=C(C(=C(C=C4)OC)OC)OC)[S-]

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C2)C(=NC(=N3)C4=C(C(=C(C=C4)OC)OC)OC)[S-]

InChI

InChI=1S/C21H20N2O4S/c1-11-5-7-15-12(9-11)10-14-20(27-15)22-19(23-21(14)28)13-6-8-16(24-2)18(26-4)17(13)25-3/h5-9H,10H2,1-4H3,(H,22,23,28)/p-1