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

Systemtic Name: (NE)-N-(4-methoxy-4-phenethylsulfanyl-1,2-dihydro-3-benzothiepin-5-ylidene)hydroxylamine Openeye Name: 4-methoxy-4-phenethylsulfanyl-1,2-dihydro-3-benzothiepin-5-one oxime CAS Name: 4-methoxy-4-(phenethylthio)-1,2-dihydro-3-benzothiepin-5-one oxime IUPAC Name: (NE)-N-(4-methoxy-4-phenethylsulfanyl-1,2-dihydro-3-benzothiepin-5-ylidene)hydroxylamine Traditional Name: 4-methoxy-4-(phenethylthio)-1,2-dihydro-3-benzothiepin-5-one oxime Formula: C19H21NO2S2 MolecularWeight: 359.50554

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C(=NO)C2=CC=CC=C2CCS1)SCCC3=CC=CC=C3

Isomeric SMILES

COC1(/C(=N/O)/C2=CC=CC=C2CCS1)SCCC3=CC=CC=C3

InChI

InChI=1S/C19H21NO2S2/c1-22-19(23-13-11-15-7-3-2-4-8-15)18(20-21)17-10-6-5-9-16(17)12-14-24-19/h2-10,21H,11-14H2,1H3/b20-18+