3-[[3-ethyl-1-(4-methylphenyl)thieno[2,3-c]pyrazol-5-yl]carbonylamino]propylazanium

Systemtic Name: 3-[[3-ethyl-1-(4-methylphenyl)thieno[2,3-c]pyrazol-5-yl]carbonylamino]propylazanium Openeye Name: 3-[[3-ethyl-1-(p-tolyl)thieno[2,3-c]pyrazole-5-carbonyl]amino]propylammonium CAS Name: 3-[[[3-ethyl-1-(4-methylphenyl)-5-thieno[2,3-c]pyrazolyl]-oxomethyl]amino]propylammonium IUPAC Name: 3-[[3-ethyl-1-(4-methylphenyl)thieno[2,3-c]pyrazole-5-carbonyl]amino]propylazanium Traditional Name: 3-[[3-ethyl-1-(p-tolyl)thieno[2,3-c]pyrazole-5-carbonyl]amino]propylammonium Formula: C18H23N4OS+ MolecularWeight: 343.46642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C=C(S2)C(=O)NCCC[NH3+])C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=NN(C2=C1C=C(S2)C(=O)NCCC[NH3+])C3=CC=C(C=C3)C

InChI

InChI=1S/C18H22N4OS/c1-3-15-14-11-16(17(23)20-10-4-9-19)24-18(14)22(21-15)13-7-5-12(2)6-8-13/h5-8,11H,3-4,9-10,19H2,1-2H3,(H,20,23)/p+1