N,N-diethyl-3-nitro-4-[(4-phenyl-1,3-thiazol-2-yl)methylamino]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-[(4-phenyl-1,3-thiazol-2-yl)methylamino]benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[(4-phenylthiazol-2-yl)methylamino]benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[(4-phenyl-2-thiazolyl)methylamino]benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-[(4-phenyl-1,3-thiazol-2-yl)methylamino]benzenesulfonamide Traditional Name: N,N-diethyl-3-nitro-4-[(4-phenylthiazol-2-yl)methylamino]benzenesulfonamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=NC(=CS2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=NC(=CS2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O4S2/c1-3-23(4-2)30(27,28)16-10-11-17(19(12-16)24(25)26)21-13-20-22-18(14-29-20)15-8-6-5-7-9-15/h5-12,14,21H,3-4,13H2,1-2H3