2-(phenylmethylsulfanyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline

Systemtic Name: 2-(phenylmethylsulfanyl)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline Openeye Name: 2-benzylsulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline CAS Name: 2-(phenylmethylthio)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline IUPAC Name: 2-benzylsulfanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline Traditional Name: 2-(benzylthio)-4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazoline Formula: C16H15F3N2S MolecularWeight: 324.36391

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NC(=N2)SCC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

C1CCC2=C(C1)C(=NC(=N2)SCC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C16H15F3N2S/c17-16(18,19)14-12-8-4-5-9-13(12)20-15(21-14)22-10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2