2-[(4S)-5-oxidanylidene-5-piperidin-1-yl-4-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentyl]guanidine

Systemtic Name: 2-[(4S)-5-oxidanylidene-5-piperidin-1-yl-4-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentyl]guanidine Openeye Name: 2-[(4S)-5-oxo-5-(1-piperidyl)-4-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentyl]guanidine CAS Name: 2-[(4S)-5-oxo-5-(1-piperidinyl)-4-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentyl]guanidine IUPAC Name: 2-[(4S)-5-oxo-5-piperidin-1-yl-4-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentyl]guanidine Traditional Name: 2-[(4S)-5-keto-5-piperidino-4-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentyl]guanidine Formula: C18H26F3N5O3S MolecularWeight: 449.49095

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(CCCN=C(N)N)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

C1CCN(CC1)C(=O)[C@H](CCCN=C(N)N)NS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C18H26F3N5O3S/c19-18(20,21)13-6-4-7-14(12-13)30(28,29)25-15(8-5-9-24-17(22)23)16(27)26-10-2-1-3-11-26/h4,6-7,12,15,25H,1-3,5,8-11H2,(H4,22,23,24)/t15-/m0/s1