4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-2-(trifluoromethyl)quinazoline

Systemtic Name: 4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-2-(trifluoromethyl)quinazoline Openeye Name: 4-[(1-phenyltetrazol-5-yl)methylsulfanyl]-2-(trifluoromethyl)quinazoline CAS Name: 4-[(1-phenyl-5-tetrazolyl)methylthio]-2-(trifluoromethyl)quinazoline IUPAC Name: 4-[(1-phenyltetrazol-5-yl)methylsulfanyl]-2-(trifluoromethyl)quinazoline Traditional Name: 4-[(1-phenyltetrazol-5-yl)methylthio]-2-(trifluoromethyl)quinazoline Formula: C17H11F3N6S MolecularWeight: 388.36965

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)CSC3=NC(=NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)CSC3=NC(=NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C17H11F3N6S/c18-17(19,20)16-21-13-9-5-4-8-12(13)15(22-16)27-10-14-23-24-25-26(14)11-6-2-1-3-7-11/h1-9H,10H2