2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-6-(2-thienyl)-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-6-thiophen-2-yl-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-6-(2-thienyl)-4-(trifluoromethyl)nicotinonitrile Formula: C19H10ClF3N2O2S2 MolecularWeight: 454.87311

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CSC3=C(C(=CC(=N3)C4=CC=CS4)C(F)(F)F)C#N)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CSC3=C(C(=CC(=N3)C4=CC=CS4)C(F)(F)F)C#N)Cl

InChI

InChI=1S/C19H10ClF3N2O2S2/c20-13-6-16-15(26-9-27-16)4-10(13)8-29-18-11(7-24)12(19(21,22)23)5-14(25-18)17-2-1-3-28-17/h1-6H,8-9H2