4-azanyl-N-methyl-3-nitro-N-(thiophen-3-ylmethyl)benzenesulfonamide

Systemtic Name: 4-azanyl-N-methyl-3-nitro-N-(thiophen-3-ylmethyl)benzenesulfonamide Openeye Name: 4-amino-N-methyl-3-nitro-N-(3-thienylmethyl)benzenesulfonamide CAS Name: 4-amino-N-methyl-3-nitro-N-(3-thiophenylmethyl)benzenesulfonamide IUPAC Name: 4-amino-N-methyl-3-nitro-N-(thiophen-3-ylmethyl)benzenesulfonamide Traditional Name: 4-amino-N-methyl-3-nitro-N-(3-thenyl)benzenesulfonamide Formula: C12H13N3O4S2 MolecularWeight: 327.37932

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)S(=O)(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CSC=C1)S(=O)(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O4S2/c1-14(7-9-4-5-20-8-9)21(18,19)10-2-3-11(13)12(6-10)15(16)17/h2-6,8H,7,13H2,1H3