4-[[5-[(2-fluorophenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[(2-fluorophenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 4-[[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile Formula: C16H11FN4S2 MolecularWeight: 342.413743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=NN=C(S2)SCC3=CC=C(C=C3)C#N)F

Isomeric SMILES

C1=CC=C(C(=C1)NC2=NN=C(S2)SCC3=CC=C(C=C3)C#N)F

InChI

InChI=1S/C16H11FN4S2/c17-13-3-1-2-4-14(13)19-15-20-21-16(23-15)22-10-12-7-5-11(9-18)6-8-12/h1-8H,10H2,(H,19,20)