diethyl-[(4S)-4-[[5-(5-methylfuran-2-yl)-2-phenyl-pyrazol-3-yl]carbonylamino]pentyl]azanium

Systemtic Name: diethyl-[(4S)-4-[[5-(5-methylfuran-2-yl)-2-phenyl-pyrazol-3-yl]carbonylamino]pentyl]azanium Openeye Name: diethyl-[(4S)-4-[[5-(5-methyl-2-furyl)-2-phenyl-pyrazole-3-carbonyl]amino]pentyl]ammonium CAS Name: diethyl-[(4S)-4-[[[5-(5-methyl-2-furanyl)-2-phenyl-3-pyrazolyl]-oxomethyl]amino]pentyl]ammonium IUPAC Name: diethyl-[(4S)-4-[[5-(5-methylfuran-2-yl)-2-phenylpyrazole-3-carbonyl]amino]pentyl]azanium Traditional Name: diethyl-[(4S)-4-[[5-(5-methyl-2-furyl)-2-phenyl-pyrazole-3-carbonyl]amino]pentyl]ammonium Formula: C24H33N4O2+ MolecularWeight: 409.54442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)NC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=C(O3)C

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=C(O3)C

InChI

InChI=1S/C24H32N4O2/c1-5-27(6-2)16-10-11-18(3)25-24(29)22-17-21(23-15-14-19(4)30-23)26-28(22)20-12-8-7-9-13-20/h7-9,12-15,17-18H,5-6,10-11,16H2,1-4H3,(H,25,29)/p+1/t18-/m0/s1