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

Systemtic Name: 1-phenyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]-1,2,3,4-tetrazol-5-amine Openeye Name: 1-phenyl-N-[[4-(1-piperidylsulfonyl)phenyl]methyl]tetrazol-5-amine CAS Name: 1-phenyl-N-[[4-(1-piperidinylsulfonyl)phenyl]methyl]-5-tetrazolamine IUPAC Name: 1-phenyl-N-[(4-piperidin-1-ylsulfonylphenyl)methyl]tetrazol-5-amine Traditional Name: (1-phenyltetrazol-5-yl)-(4-piperidinosulfonylbenzyl)amine Formula: C19H22N6O2S MolecularWeight: 398.48198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C19H22N6O2S/c26-28(27,24-13-5-2-6-14-24)18-11-9-16(10-12-18)15-20-19-21-22-23-25(19)17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-15H2,(H,20,21,23)