2-(4-ethoxyphenyl)-9-methyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate

Systemtic Name: 2-(4-ethoxyphenyl)-9-methyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate Openeye Name: 2-(4-ethoxyphenyl)-9-methyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate CAS Name: 2-(4-ethoxyphenyl)-9-methyl-5H-[1]benzopyrano[2,3-d]pyrimidine-4-thiolate IUPAC Name: 2-(4-ethoxyphenyl)-9-methyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate Traditional Name: 9-methyl-2-p-phenetyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate Formula: C20H17N2O2S- MolecularWeight: 349.42618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(CC4=C(O3)C(=CC=C4)C)C(=N2)[S-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(CC4=C(O3)C(=CC=C4)C)C(=N2)[S-]

InChI

InChI=1S/C20H18N2O2S/c1-3-23-15-9-7-13(8-10-15)18-21-19-16(20(25)22-18)11-14-6-4-5-12(2)17(14)24-19/h4-10H,3,11H2,1-2H3,(H,21,22,25)/p-1