3-methoxy-5-(phenylmethyl)sulfinyl-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-methoxy-5-(phenylmethyl)sulfinyl-1,2-thiazole-4-carbonitrile Openeye Name: 5-benzylsulfinyl-3-methoxy-isothiazole-4-carbonitrile CAS Name: 3-methoxy-5-(phenylmethyl)sulfinyl-4-isothiazolecarbonitrile IUPAC Name: 5-benzylsulfinyl-3-methoxy-1,2-thiazole-4-carbonitrile Traditional Name: 5-benzylsulfinyl-3-methoxy-isothiazole-4-carbonitrile Formula: C12H10N2O2S2 MolecularWeight: 278.35

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NSC(=C1C#N)S(=O)CC2=CC=CC=C2

Isomeric SMILES

COC1=NSC(=C1C#N)S(=O)CC2=CC=CC=C2

InChI

InChI=1S/C12H10N2O2S2/c1-16-11-10(7-13)12(17-14-11)18(15)8-9-5-3-2-4-6-9/h2-6H,8H2,1H3