3-phenylmethoxy-5-(phenylmethylsulfanyl)-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-phenylmethoxy-5-(phenylmethylsulfanyl)-1,2-thiazole-4-carbonitrile Openeye Name: 3-benzyloxy-5-benzylsulfanyl-isothiazole-4-carbonitrile CAS Name: 3-phenylmethoxy-5-(phenylmethylthio)-4-isothiazolecarbonitrile IUPAC Name: 5-benzylsulfanyl-3-phenylmethoxy-1,2-thiazole-4-carbonitrile Traditional Name: 3-benzoxy-5-(benzylthio)isothiazole-4-carbonitrile Formula: C18H14N2OS2 MolecularWeight: 338.44656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NSC(=C2C#N)SCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC2=NSC(=C2C#N)SCC3=CC=CC=C3

InChI

InChI=1S/C18H14N2OS2/c19-11-16-17(21-12-14-7-3-1-4-8-14)20-23-18(16)22-13-15-9-5-2-6-10-15/h1-10H,12-13H2