2-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-4-phenyl-1,3-thiazole-5-carboxamide

Systemtic Name: 2-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-4-phenyl-1,3-thiazole-5-carboxamide Openeye Name: 2-methyl-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-4-phenyl-thiazole-5-carboxamide CAS Name: 2-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-4-phenyl-5-thiazolecarboxamide IUPAC Name: 2-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-4-phenyl-1,3-thiazole-5-carboxamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]-2-methyl-4-phenyl-thiazole-5-carboxamide Formula: C20H20N4O5S2 MolecularWeight: 460.5266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=C(S1)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H20N4O5S2/c1-13-23-18(14-6-4-3-5-7-14)19(30-13)20(25)22-11-10-21-16-9-8-15(31(2,28)29)12-17(16)24(26)27/h3-9,12,21H,10-11H2,1-2H3,(H,22,25)