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

Systemtic Name: 2-(3-chlorophenyl)-9-methoxy-5H-chromeno[2,3-d]pyrimidine-4-thiolate Openeye Name: 2-(3-chlorophenyl)-9-methoxy-5H-chromeno[2,3-d]pyrimidine-4-thiolate CAS Name: 2-(3-chlorophenyl)-9-methoxy-5H-[1]benzopyrano[2,3-d]pyrimidine-4-thiolate IUPAC Name: 2-(3-chlorophenyl)-9-methoxy-5H-chromeno[2,3-d]pyrimidine-4-thiolate Traditional Name: 2-(3-chlorophenyl)-9-methoxy-5H-chromeno[2,3-d]pyrimidine-4-thiolate Formula: C18H12ClN2O2S- MolecularWeight: 355.81808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC3=C(C2)C(=NC(=N3)C4=CC(=CC=C4)Cl)[S-]

Isomeric SMILES

COC1=CC=CC2=C1OC3=C(C2)C(=NC(=N3)C4=CC(=CC=C4)Cl)[S-]

InChI

InChI=1S/C18H13ClN2O2S/c1-22-14-7-3-4-10-9-13-17(23-15(10)14)20-16(21-18(13)24)11-5-2-6-12(19)8-11/h2-8H,9H2,1H3,(H,20,21,24)/p-1