4-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]quinazoline

Systemtic Name: 4-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]quinazoline Openeye Name: 4-[2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethyl]quinazoline CAS Name: 4-[2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethyl]quinazoline IUPAC Name: 4-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]quinazoline Traditional Name: 4-[2-[[5-(trifluoromethyl)-2-pyridyl]thio]ethyl]quinazoline Formula: C16H12F3N3S MolecularWeight: 335.34679

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)CCSC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)CCSC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H12F3N3S/c17-16(18,19)11-5-6-15(20-9-11)23-8-7-14-12-3-1-2-4-13(12)21-10-22-14/h1-6,9-10H,7-8H2