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

Systemtic Name: 2-(3-chlorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate Openeye Name: 2-(3-chlorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate CAS Name: 2-(3-chlorophenyl)-7-methyl-5H-[1]benzopyrano[2,3-d]pyrimidine-4-thiolate IUPAC Name: 2-(3-chlorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate Traditional Name: 2-(3-chlorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidine-4-thiolate Formula: C18H12ClN2OS- MolecularWeight: 339.81868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13ClN2OS/c1-10-5-6-15-12(7-10)9-14-17(22-15)20-16(21-18(14)23)11-3-2-4-13(19)8-11/h2-8H,9H2,1H3,(H,20,21,23)/p-1