N-methyl-4-methylsulfonyl-2-nitro-N-(thiophen-2-ylmethyl)aniline

Systemtic Name: N-methyl-4-methylsulfonyl-2-nitro-N-(thiophen-2-ylmethyl)aniline Openeye Name: N-methyl-4-methylsulfonyl-2-nitro-N-(2-thienylmethyl)aniline CAS Name: N-methyl-4-methylsulfonyl-2-nitro-N-(thiophen-2-ylmethyl)aniline IUPAC Name: N-methyl-4-methylsulfonyl-2-nitro-N-(thiophen-2-ylmethyl)aniline Traditional Name: (4-mesyl-2-nitro-phenyl)-methyl-(2-thenyl)amine Formula: C13H14N2O4S2 MolecularWeight: 326.39126

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CS1)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CS1)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O4S2/c1-14(9-10-4-3-7-20-10)12-6-5-11(21(2,18)19)8-13(12)15(16)17/h3-8H,9H2,1-2H3