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

Systemtic Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[3-methyl-1-(3-methylphenyl)thieno[2,3-c]pyrazol-5-yl]methanone Openeye Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[3-methyl-1-(m-tolyl)thieno[2,3-c]pyrazol-5-yl]methanone CAS Name: (4-cyclopentyl-1-piperazin-4-iumyl)-[3-methyl-1-(3-methylphenyl)-5-thieno[2,3-c]pyrazolyl]methanone IUPAC Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[3-methyl-1-(3-methylphenyl)thieno[2,3-c]pyrazol-5-yl]methanone Traditional Name: (4-cyclopentylpiperazin-4-ium-1-yl)-[3-methyl-1-(m-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=C1)N2C3=C(C=C(S3)C(=O)N4CC[NH+](CC4)C5CCCC5)C(=N2)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=C(C=C(S3)C(=O)N4CC[NH+](CC4)C5CCCC5)C(=N2)C

InChI

InChI=1S/C23H28N4OS/c1-16-6-5-9-19(14-16)27-23-20(17(2)24-27)15-21(29-23)22(28)26-12-10-25(11-13-26)18-7-3-4-8-18/h5-6,9,14-15,18H,3-4,7-8,10-13H2,1-2H3/p+1