3-azanyl-5-methyl-2-methylsulfonyl-6-nitro-benzenethiol

Systemtic Name: 3-azanyl-5-methyl-2-methylsulfonyl-6-nitro-benzenethiol Openeye Name: 3-amino-5-methyl-2-methylsulfonyl-6-nitro-benzenethiol CAS Name: 3-amino-5-methyl-2-methylsulfonyl-6-nitrobenzenethiol IUPAC Name: 3-amino-5-methyl-2-methylsulfonyl-6-nitrobenzenethiol Traditional Name: 3-amino-2-mesyl-5-methyl-6-nitro-benzenethiol Formula: C8H10N2O4S2 MolecularWeight: 262.306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1[N+](=O)[O-])S)S(=O)(=O)C)N

Isomeric SMILES

CC1=CC(=C(C(=C1[N+](=O)[O-])S)S(=O)(=O)C)N

InChI

InChI=1S/C8H10N2O4S2/c1-4-3-5(9)8(16(2,13)14)7(15)6(4)10(11)12/h3,15H,9H2,1-2H3