N-[4-[3,4-bis(fluoranyl)phenyl]-5-methyl-1,3-thiazol-2-yl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[4-[3,4-bis(fluoranyl)phenyl]-5-methyl-1,3-thiazol-2-yl]-2-methyl-3-nitro-benzamide Openeye Name: N-[4-(3,4-difluorophenyl)-5-methyl-thiazol-2-yl]-2-methyl-3-nitro-benzamide CAS Name: N-[4-(3,4-difluorophenyl)-5-methyl-2-thiazolyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[4-(3,4-difluorophenyl)-5-methyl-1,3-thiazol-2-yl]-2-methyl-3-nitrobenzamide Traditional Name: N-[4-(3,4-difluorophenyl)-5-methyl-thiazol-2-yl]-2-methyl-3-nitro-benzamide Formula: C18H13F2N3O3S MolecularWeight: 389.375926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=NC(=C(S2)C)C3=CC(=C(C=C3)F)F

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=NC(=C(S2)C)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C18H13F2N3O3S/c1-9-12(4-3-5-15(9)23(25)26)17(24)22-18-21-16(10(2)27-18)11-6-7-13(19)14(20)8-11/h3-8H,1-2H3,(H,21,22,24)