4-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methylsulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methylsulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[2-(2-furyl)thiazol-4-yl]methylsulfanylmethyl]benzonitrile CAS Name: 4-[[[2-(2-furanyl)-4-thiazolyl]methylthio]methyl]benzonitrile IUPAC Name: 4-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methylsulfanylmethyl]benzonitrile Traditional Name: 4-[[[2-(2-furyl)thiazol-4-yl]methylthio]methyl]benzonitrile Formula: C16H12N2OS2 MolecularWeight: 312.40928

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=NC(=CS2)CSCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=COC(=C1)C2=NC(=CS2)CSCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H12N2OS2/c17-8-12-3-5-13(6-4-12)9-20-10-14-11-21-16(18-14)15-2-1-7-19-15/h1-7,11H,9-10H2