N,N-diethyl-4-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[methyl-[(3-methyl-2-thienyl)methyl]amino]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[methyl-[(3-methyl-2-thiophenyl)methyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[methyl-[(3-methylthiophen-2-yl)methyl]amino]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[methyl-[(3-methyl-2-thienyl)methyl]amino]-3-nitro-benzenesulfonamide Formula: C17H23N3O4S2 MolecularWeight: 397.51222

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=C(C=CS2)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N(C)CC2=C(C=CS2)C)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O4S2/c1-5-19(6-2)26(23,24)14-7-8-15(16(11-14)20(21)22)18(4)12-17-13(3)9-10-25-17/h7-11H,5-6,12H2,1-4H3