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

Systemtic Name: N-[2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-[2-(3-fluorophenyl)thiazol-4-yl]ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-[2-(3-fluorophenyl)-4-thiazolyl]ethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]ethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-[2-(3-fluorophenyl)thiazol-4-yl]ethyl]-4-methyl-3-nitro-benzamide Formula: C19H16FN3O3S MolecularWeight: 385.412043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCC2=CSC(=N2)C3=CC(=CC=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCC2=CSC(=N2)C3=CC(=CC=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C19H16FN3O3S/c1-12-5-6-13(10-17(12)23(25)26)18(24)21-8-7-16-11-27-19(22-16)14-3-2-4-15(20)9-14/h2-6,9-11H,7-8H2,1H3,(H,21,24)