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

Systemtic Name: 2-[(1-phenyl-3-propan-2-yl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]ethylazanium Openeye Name: 2-[(3-isopropyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]ethylammonium CAS Name: 2-[[oxo-(1-phenyl-3-propan-2-yl-5-thieno[2,3-c]pyrazolyl)methyl]amino]ethylammonium IUPAC Name: 2-[(1-phenyl-3-propan-2-ylthieno[2,3-c]pyrazole-5-carbonyl)amino]ethylazanium Traditional Name: 2-[(3-isopropyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]ethylammonium Formula: C17H21N4OS+ MolecularWeight: 329.43984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4OS/c1-11(2)15-13-10-14(16(22)19-9-8-18)23-17(13)21(20-15)12-6-4-3-5-7-12/h3-7,10-11H,8-9,18H2,1-2H3,(H,19,22)/p+1