(NE)-N-(4-methoxy-4-methylsulfanyl-1,2-dihydro-3-benzothiepin-5-ylidene)hydroxylamine

Systemtic Name: (NE)-N-(4-methoxy-4-methylsulfanyl-1,2-dihydro-3-benzothiepin-5-ylidene)hydroxylamine Openeye Name: 4-methoxy-4-methylsulfanyl-1,2-dihydro-3-benzothiepin-5-one oxime CAS Name: 4-methoxy-4-(methylthio)-1,2-dihydro-3-benzothiepin-5-one oxime IUPAC Name: (NE)-N-(4-methoxy-4-methylsulfanyl-1,2-dihydro-3-benzothiepin-5-ylidene)hydroxylamine Traditional Name: 4-methoxy-4-(methylthio)-1,2-dihydro-3-benzothiepin-5-one oxime Formula: C12H15NO2S2 MolecularWeight: 269.383

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C(=NO)C2=CC=CC=C2CCS1)SC

Isomeric SMILES

COC1(/C(=N/O)/C2=CC=CC=C2CCS1)SC

InChI

InChI=1S/C12H15NO2S2/c1-15-12(16-2)11(13-14)10-6-4-3-5-9(10)7-8-17-12/h3-6,14H,7-8H2,1-2H3/b13-11+