1-(3-chlorophenyl)-3-methyl-N-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: 1-(3-chlorophenyl)-3-methyl-N-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 1-(3-chlorophenyl)-3-methyl-N-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-c]pyrazole-5-carboxamide CAS Name: 1-(3-chlorophenyl)-3-methyl-N-(4-methyl-1-piperazin-4-iumyl)-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 1-(3-chlorophenyl)-3-methyl-N-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 1-(3-chlorophenyl)-3-methyl-N-(4-methylpiperazin-4-ium-1-yl)thieno[2,3-c]pyrazole-5-carboxamide Formula: C18H21ClN5OS+ MolecularWeight: 390.91024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NN3CC[NH+](CC3)C)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NN3CC[NH+](CC3)C)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H20ClN5OS/c1-12-15-11-16(17(25)21-23-8-6-22(2)7-9-23)26-18(15)24(20-12)14-5-3-4-13(19)10-14/h3-5,10-11H,6-9H2,1-2H3,(H,21,25)/p+1