3-methyl-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: 3-methyl-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 3-methyl-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: 3-methyl-N-[3-(4-methyl-1-piperazine-1,4-diiumyl)propyl]-1-phenyl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 3-methyl-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-1-phenylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 3-methyl-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C21H29N5OS+2 MolecularWeight: 399.55286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NCCC[NH+]3CC[NH+](CC3)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NCCC[NH+]3CC[NH+](CC3)C)C4=CC=CC=C4

InChI

InChI=1S/C21H27N5OS/c1-16-18-15-19(28-21(18)26(23-16)17-7-4-3-5-8-17)20(27)22-9-6-10-25-13-11-24(2)12-14-25/h3-5,7-8,15H,6,9-14H2,1-2H3,(H,22,27)/p+2