N-ethyl-4-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: N-ethyl-4-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: N-ethyl-4-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]-3-nitro-N-phenyl-benzenesulfonamide CAS Name: N-ethyl-4-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: N-ethyl-4-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]-3-nitro-N-phenylbenzenesulfonamide Traditional Name: N-ethyl-4-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]-3-nitro-N-phenyl-benzenesulfonamide Formula: C19H22N6O4S MolecularWeight: 430.48078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)NC(C)C3=NN=CN3C)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)NC(C)C3=NN=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C19H22N6O4S/c1-4-24(15-8-6-5-7-9-15)30(28,29)16-10-11-17(18(12-16)25(26)27)21-14(2)19-22-20-13-23(19)3/h5-14,21H,4H2,1-3H3