2-[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-1,3-benzothiazole

Systemtic Name: 2-[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-1,3-benzothiazole Openeye Name: 2-[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-1,3-benzothiazole CAS Name: 2-[[6,7-dimethoxy-2-(trifluoromethyl)-4-quinazolinyl]thio]-1,3-benzothiazole IUPAC Name: 2-[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-1,3-benzothiazole Traditional Name: 2-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]thio]-1,3-benzothiazole Formula: C18H12F3N3O2S2 MolecularWeight: 423.43199

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)SC3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)SC3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C18H12F3N3O2S2/c1-25-12-7-9-11(8-13(12)26-2)22-16(18(19,20)21)24-15(9)28-17-23-10-5-3-4-6-14(10)27-17/h3-8H,1-2H3