3-[[1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazol-5-yl]carbonylamino]propyl-diethyl-azanium

Systemtic Name: 3-[[1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazol-5-yl]carbonylamino]propyl-diethyl-azanium Openeye Name: 3-[[1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carbonyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[[1-(4-chlorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolyl]-oxomethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[1-(4-chlorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carbonyl]amino]propyl-diethylazanium Traditional Name: 3-[[1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carbonyl]amino]propyl-diethyl-ammonium Formula: C20H26ClN4OS+ MolecularWeight: 405.96464

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)C1=CC2=C(S1)N(N=C2C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)C1=CC2=C(S1)N(N=C2C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H25ClN4OS/c1-4-24(5-2)12-6-11-22-19(26)18-13-17-14(3)23-25(20(17)27-18)16-9-7-15(21)8-10-16/h7-10,13H,4-6,11-12H2,1-3H3,(H,22,26)/p+1