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

Systemtic Name: [3-methyl-1-(3-methylphenyl)thieno[2,3-c]pyrazol-5-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [3-methyl-1-(m-tolyl)thieno[2,3-c]pyrazol-5-yl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [3-methyl-1-(3-methylphenyl)-5-thieno[2,3-c]pyrazolyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [3-methyl-1-(3-methylphenyl)thieno[2,3-c]pyrazol-5-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [3-methyl-1-(m-tolyl)thieno[2,3-c]pyrazol-5-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C19H23N4OS+ MolecularWeight: 355.47712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4OS/c1-13-5-4-6-15(11-13)23-19-16(14(2)20-23)12-17(25-19)18(24)22-9-7-21(3)8-10-22/h4-6,11-12H,7-10H2,1-3H3/p+1