1-[(E)-hept-1-en-3-ynyl]sulfonyl-4-pyridin-2-yl-piperazine

Systemtic Name: 1-[(E)-hept-1-en-3-ynyl]sulfonyl-4-pyridin-2-yl-piperazine Openeye Name: 1-[(E)-hept-1-en-3-ynyl]sulfonyl-4-(2-pyridyl)piperazine CAS Name: 1-[(E)-hept-1-en-3-ynyl]sulfonyl-4-(2-pyridinyl)piperazine IUPAC Name: 1-[(E)-hept-1-en-3-ynyl]sulfonyl-4-pyridin-2-ylpiperazine Traditional Name: 1-[(E)-hept-1-en-3-ynyl]sulfonyl-4-(2-pyridyl)piperazine Formula: C16H21N3O2S MolecularWeight: 319.42184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC=CS(=O)(=O)N1CCN(CC1)C2=CC=CC=N2

Isomeric SMILES

CCCC#C/C=C/S(=O)(=O)N1CCN(CC1)C2=CC=CC=N2

InChI

InChI=1S/C16H21N3O2S/c1-2-3-4-5-8-15-22(20,21)19-13-11-18(12-14-19)16-9-6-7-10-17-16/h6-10,15H,2-3,11-14H2,1H3/b15-8+