1-(4-nitrophenyl)-3-sulfanyl-6,7-dihydro-5H-2-benzothiophen-4-one

Systemtic Name: 1-(4-nitrophenyl)-3-sulfanyl-6,7-dihydro-5H-2-benzothiophen-4-one Openeye Name: 1-(4-nitrophenyl)-3-sulfanyl-6,7-dihydro-5H-2-benzothiophen-4-one CAS Name: 3-mercapto-1-(4-nitrophenyl)-6,7-dihydro-5H-2-benzothiophen-4-one IUPAC Name: 1-(4-nitrophenyl)-3-sulfanyl-6,7-dihydro-5H-2-benzothiophen-4-one Traditional Name: 3-mercapto-1-(4-nitrophenyl)-6,7-dihydro-5H-isobenzothiophen-4-one Formula: C14H11NO3S2 MolecularWeight: 305.37204

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(SC(=C2C(=O)C1)S)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(SC(=C2C(=O)C1)S)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11NO3S2/c16-11-3-1-2-10-12(11)14(19)20-13(10)8-4-6-9(7-5-8)15(17)18/h4-7,19H,1-3H2