N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-2-(4-pyrazol-1-ylphenyl)ethanamide

Systemtic Name: N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-2-(4-pyrazol-1-ylphenyl)ethanamide Openeye Name: N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-2-(4-pyrazol-1-ylphenyl)acetamide CAS Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-[4-(1-pyrazolyl)phenyl]acetamide IUPAC Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-(4-pyrazol-1-ylphenyl)acetamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]-2-(4-pyrazol-1-ylphenyl)acetamide Formula: C20H21N5O5S MolecularWeight: 443.47624

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CC2=CC=C(C=C2)N3C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CC2=CC=C(C=C2)N3C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O5S/c1-31(29,30)17-7-8-18(19(14-17)25(27)28)21-10-11-22-20(26)13-15-3-5-16(6-4-15)24-12-2-9-23-24/h2-9,12,14,21H,10-11,13H2,1H3,(H,22,26)