N-[2-(dimethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-[2-(dimethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Openeye Name: N-[2-(dimethylamino)-5-(1-piperidylsulfonyl)phenyl]-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide CAS Name: N-[2-(dimethylamino)-5-(1-piperidinylsulfonyl)phenyl]-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-[2-(dimethylamino)-5-piperidin-1-ylsulfonylphenyl]-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Traditional Name: N-[2-(dimethylamino)-5-piperidinosulfonyl-phenyl]-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Formula: C23H27FN6O3S MolecularWeight: 486.562283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)N(C)C

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)N(C)C

InChI

InChI=1S/C23H27FN6O3S/c1-16-25-22(27-30(16)18-9-7-17(24)8-10-18)23(31)26-20-15-19(11-12-21(20)28(2)3)34(32,33)29-13-5-4-6-14-29/h7-12,15H,4-6,13-14H2,1-3H3,(H,26,31)