2-(2,5-dimethyl-1H-indol-3-yl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide

Systemtic Name: 2-(2,5-dimethyl-1H-indol-3-yl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide Openeye Name: 2-(2,5-dimethyl-1H-indol-3-yl)-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]acetamide CAS Name: 2-(2,5-dimethyl-1H-indol-3-yl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide IUPAC Name: 2-(2,5-dimethyl-1H-indol-3-yl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide Traditional Name: 2-(2,5-dimethyl-1H-indol-3-yl)-N-[2-(4-mesyl-2-nitro-anilino)ethyl]acetamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CC(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CC(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-])C

InChI

InChI=1S/C21H24N4O5S/c1-13-4-6-18-17(10-13)16(14(2)24-18)12-21(26)23-9-8-22-19-7-5-15(31(3,29)30)11-20(19)25(27)28/h4-7,10-11,22,24H,8-9,12H2,1-3H3,(H,23,26)