4-[(5-chloranylthiophen-2-yl)methyl-methyl-amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(5-chloranylthiophen-2-yl)methyl-methyl-amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[(5-chloro-2-thienyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide CAS Name: 4-[(5-chloro-2-thiophenyl)methyl-methylamino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(5-chlorothiophen-2-yl)methyl-methylamino]-3-nitrobenzenesulfonamide Traditional Name: 4-[(5-chloro-2-thienyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide Formula: C12H12ClN3O4S2 MolecularWeight: 361.82438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Cl)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(S1)Cl)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C12H12ClN3O4S2/c1-15(7-8-2-5-12(13)21-8)10-4-3-9(22(14,19)20)6-11(10)16(17)18/h2-6H,7H2,1H3,(H2,14,19,20)