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

Systemtic Name: 5-methyl-2-phenyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-methyl-2-phenyl-N-[[4-(1-piperidylsulfonyl)phenyl]methyl]triazole-4-carboxamide CAS Name: 5-methyl-2-phenyl-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]-4-triazolecarboxamide IUPAC Name: 5-methyl-2-phenyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]triazole-4-carboxamide Traditional Name: 5-methyl-2-phenyl-N-(4-piperidinosulfonylbenzyl)triazole-4-carboxamide Formula: C22H25N5O3S MolecularWeight: 439.5306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5O3S/c1-17-21(25-27(24-17)19-8-4-2-5-9-19)22(28)23-16-18-10-12-20(13-11-18)31(29,30)26-14-6-3-7-15-26/h2,4-5,8-13H,3,6-7,14-16H2,1H3,(H,23,28)