S-phthalazin-1-yl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbothioate

Systemtic Name: S-phthalazin-1-yl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbothioate Openeye Name: S-phthalazin-1-yl 3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbothioate CAS Name: 3-(2-chlorophenyl)-5-methyl-4-isoxazolecarbothioic acid S-(1-phthalazinyl) ester IUPAC Name: S-phthalazin-1-yl 3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbothioate Traditional Name: 3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbothioic acid S-phthalazin-1-yl ester Formula: C19H12ClN3O2S MolecularWeight: 381.83548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)SC3=NN=CC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)SC3=NN=CC4=CC=CC=C43

InChI

InChI=1S/C19H12ClN3O2S/c1-11-16(17(23-25-11)14-8-4-5-9-15(14)20)19(24)26-18-13-7-3-2-6-12(13)10-21-22-18/h2-10H,1H3