(4-cyclopentylpiperazin-4-ium-1-yl)-[3-methyl-1-(2-methylphenyl)thieno[2,3-c]pyrazol-5-yl]methanone

Systemtic Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[3-methyl-1-(2-methylphenyl)thieno[2,3-c]pyrazol-5-yl]methanone Openeye Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[3-methyl-1-(o-tolyl)thieno[2,3-c]pyrazol-5-yl]methanone CAS Name: (4-cyclopentyl-1-piperazin-4-iumyl)-[3-methyl-1-(2-methylphenyl)-5-thieno[2,3-c]pyrazolyl]methanone IUPAC Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[3-methyl-1-(2-methylphenyl)thieno[2,3-c]pyrazol-5-yl]methanone Traditional Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[3-methyl-1-(o-tolyl)thieno[2,3-c]pyrazol-5-yl]methanone Formula: C23H29N4OS+ MolecularWeight: 409.56756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=C(C=C(S3)C(=O)N4CC[NH+](CC4)C5CCCC5)C(=N2)C

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(C=C(S3)C(=O)N4CC[NH+](CC4)C5CCCC5)C(=N2)C

InChI

InChI=1S/C23H28N4OS/c1-16-7-3-6-10-20(16)27-23-19(17(2)24-27)15-21(29-23)22(28)26-13-11-25(12-14-26)18-8-4-5-9-18/h3,6-7,10,15,18H,4-5,8-9,11-14H2,1-2H3/p+1