3-fluoranyl-4-methyl-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-nitro-benzamide

Systemtic Name: 3-fluoranyl-4-methyl-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-nitro-benzamide Openeye Name: 3-fluoro-4-methyl-5-nitro-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-fluoro-4-methyl-N-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide IUPAC Name: 3-fluoro-4-methyl-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide Traditional Name: 3-fluoro-4-methyl-N-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]-5-nitro-benzamide Formula: C18H15FN4O3S2 MolecularWeight: 418.465103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC(=C(C(=C3)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC(=C(C(=C3)F)C)[N+](=O)[O-]

InChI

InChI=1S/C18H15FN4O3S2/c1-10-3-5-12(6-4-10)9-27-18-22-21-17(28-18)20-16(24)13-7-14(19)11(2)15(8-13)23(25)26/h3-8H,9H2,1-2H3,(H,20,21,24)