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

Systemtic Name: 9-ethoxy-2-(3-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate Openeye Name: 9-ethoxy-2-(3-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate CAS Name: 9-ethoxy-2-(3-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidine-4-thiolate IUPAC Name: 9-ethoxy-2-(3-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate Traditional Name: 9-ethoxy-2-(3-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine-4-thiolate Formula: C20H17N2O3S- MolecularWeight: 365.42558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC3=C(C2)C(=NC(=N3)C4=CC(=CC=C4)OC)[S-]

Isomeric SMILES

CCOC1=CC=CC2=C1OC3=C(C2)C(=NC(=N3)C4=CC(=CC=C4)OC)[S-]

InChI

InChI=1S/C20H18N2O3S/c1-3-24-16-9-5-6-12-11-15-19(25-17(12)16)21-18(22-20(15)26)13-7-4-8-14(10-13)23-2/h4-10H,3,11H2,1-2H3,(H,21,22,26)/p-1