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

Systemtic Name: 3-methoxy-5-(phenylmethyl)sulfonyl-1,2-thiazole-4-carbonitrile Openeye Name: 5-benzylsulfonyl-3-methoxy-isothiazole-4-carbonitrile CAS Name: 3-methoxy-5-(phenylmethyl)sulfonyl-4-isothiazolecarbonitrile IUPAC Name: 5-benzylsulfonyl-3-methoxy-1,2-thiazole-4-carbonitrile Traditional Name: 5-benzylsulfonyl-3-methoxy-isothiazole-4-carbonitrile Formula: C12H10N2O3S2 MolecularWeight: 294.3494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N2O3S2/c1-17-11-10(7-13)12(18-14-11)19(15,16)8-9-5-3-2-4-6-9/h2-6H,8H2,1H3