N-cyclohexyl-N-[(4-fluorophenyl)methyl]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-benzamide

Systemtic Name: N-cyclohexyl-N-[(4-fluorophenyl)methyl]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-benzamide Openeye Name: N-cyclohexyl-N-[(4-fluorophenyl)methyl]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-benzamide CAS Name: N-cyclohexyl-N-[(4-fluorophenyl)methyl]-4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitrobenzamide IUPAC Name: N-cyclohexyl-N-[(4-fluorophenyl)methyl]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzamide Traditional Name: N-cyclohexyl-N-(4-fluorobenzyl)-4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitro-benzamide Formula: C23H24FN5O3S MolecularWeight: 469.531763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=C(C=C(C=C2)C(=O)N(CC3=CC=C(C=C3)F)C4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CN1C=NN=C1SC2=C(C=C(C=C2)C(=O)N(CC3=CC=C(C=C3)F)C4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H24FN5O3S/c1-27-15-25-26-23(27)33-21-12-9-17(13-20(21)29(31)32)22(30)28(19-5-3-2-4-6-19)14-16-7-10-18(24)11-8-16/h7-13,15,19H,2-6,14H2,1H3