7-(3,4-dimethoxyphenyl)-2-methyl-4-phenethylsulfanyl-[1,3]thiazolo[4,5-d]pyridazine

Systemtic Name: 7-(3,4-dimethoxyphenyl)-2-methyl-4-phenethylsulfanyl-[1,3]thiazolo[4,5-d]pyridazine Openeye Name: 7-(3,4-dimethoxyphenyl)-2-methyl-4-phenethylsulfanyl-thiazolo[4,5-d]pyridazine CAS Name: 7-(3,4-dimethoxyphenyl)-2-methyl-4-(phenethylthio)thiazolo[4,5-d]pyridazine IUPAC Name: 7-(3,4-dimethoxyphenyl)-2-methyl-4-phenethylsulfanyl-[1,3]thiazolo[4,5-d]pyridazine Traditional Name: 7-(3,4-dimethoxyphenyl)-2-methyl-4-(phenethylthio)thiazolo[4,5-d]pyridazine Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C(=NN=C2SCCC3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=NC2=C(S1)C(=NN=C2SCCC3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C22H21N3O2S2/c1-14-23-20-21(29-14)19(16-9-10-17(26-2)18(13-16)27-3)24-25-22(20)28-12-11-15-7-5-4-6-8-15/h4-10,13H,11-12H2,1-3H3