N-[3-[2-[(2-fluorophenyl)amino]-1,3-thiazol-4-yl]phenyl]-4-nitro-benzamide

Systemtic Name: N-[3-[2-[(2-fluorophenyl)amino]-1,3-thiazol-4-yl]phenyl]-4-nitro-benzamide Openeye Name: N-[3-[2-(2-fluoroanilino)thiazol-4-yl]phenyl]-4-nitro-benzamide CAS Name: N-[3-[2-(2-fluoroanilino)-4-thiazolyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[3-[2-(2-fluoroanilino)-1,3-thiazol-4-yl]phenyl]-4-nitrobenzamide Traditional Name: N-[3-[2-(2-fluoroanilino)thiazol-4-yl]phenyl]-4-nitro-benzamide Formula: C22H15FN4O3S MolecularWeight: 434.442903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=NC(=CS2)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)NC2=NC(=CS2)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])F

InChI

InChI=1S/C22H15FN4O3S/c23-18-6-1-2-7-19(18)25-22-26-20(13-31-22)15-4-3-5-16(12-15)24-21(28)14-8-10-17(11-9-14)27(29)30/h1-13H,(H,24,28)(H,25,26)