2-[[(2-chloranyl-4-nitro-phenyl)carbonyl-[(4-fluorophenyl)methyl]amino]methyl]-N-[(4-fluorophenyl)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(2-chloranyl-4-nitro-phenyl)carbonyl-[(4-fluorophenyl)methyl]amino]methyl]-N-[(4-fluorophenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(2-chloro-4-nitro-benzoyl)-[(4-fluorophenyl)methyl]amino]methyl]-N-[(4-fluorophenyl)methyl]thiazole-4-carboxamide CAS Name: 2-[[[(2-chloro-4-nitrophenyl)-oxomethyl]-[(4-fluorophenyl)methyl]amino]methyl]-N-[(4-fluorophenyl)methyl]-4-thiazolecarboxamide IUPAC Name: 2-[[(2-chloro-4-nitrobenzoyl)-[(4-fluorophenyl)methyl]amino]methyl]-N-[(4-fluorophenyl)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(2-chloro-4-nitro-benzoyl)-(4-fluorobenzyl)amino]methyl]-N-(4-fluorobenzyl)thiazole-4-carboxamide Formula: C26H19ClF2N4O4S MolecularWeight: 556.968266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CSC(=N2)CN(CC3=CC=C(C=C3)F)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CSC(=N2)CN(CC3=CC=C(C=C3)F)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)F

InChI

InChI=1S/C26H19ClF2N4O4S/c27-22-11-20(33(36)37)9-10-21(22)26(35)32(13-17-3-7-19(29)8-4-17)14-24-31-23(15-38-24)25(34)30-12-16-1-5-18(28)6-2-16/h1-11,15H,12-14H2,(H,30,34)