3-[(1-phenyl-3-propan-2-yl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]propylazanium

Systemtic Name: 3-[(1-phenyl-3-propan-2-yl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]propylazanium Openeye Name: 3-[(3-isopropyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]propylammonium CAS Name: 3-[[oxo-(1-phenyl-3-propan-2-yl-5-thieno[2,3-c]pyrazolyl)methyl]amino]propylammonium IUPAC Name: 3-[(1-phenyl-3-propan-2-ylthieno[2,3-c]pyrazole-5-carbonyl)amino]propylazanium Traditional Name: 3-[(3-isopropyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]propylammonium Formula: C18H23N4OS+ MolecularWeight: 343.46642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C2=C1C=C(S2)C(=O)NCCC[NH3+])C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=NN(C2=C1C=C(S2)C(=O)NCCC[NH3+])C3=CC=CC=C3

InChI

InChI=1S/C18H22N4OS/c1-12(2)16-14-11-15(17(23)20-10-6-9-19)24-18(14)22(21-16)13-7-4-3-5-8-13/h3-5,7-8,11-12H,6,9-10,19H2,1-2H3,(H,20,23)/p+1