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

Systemtic Name: [3-methyl-1-(2-methylphenyl)thieno[2,3-c]pyrazol-5-yl]-(4-phenethylpiperazin-1-yl)methanone Openeye Name: [3-methyl-1-(o-tolyl)thieno[2,3-c]pyrazol-5-yl]-(4-phenethylpiperazin-1-yl)methanone CAS Name: [3-methyl-1-(2-methylphenyl)-5-thieno[2,3-c]pyrazolyl]-(4-phenethyl-1-piperazinyl)methanone IUPAC Name: [3-methyl-1-(2-methylphenyl)thieno[2,3-c]pyrazol-5-yl]-(4-phenethylpiperazin-1-yl)methanone Traditional Name: [3-methyl-1-(o-tolyl)thieno[2,3-c]pyrazol-5-yl]-(4-phenethylpiperazino)methanone Formula: C26H28N4OS MolecularWeight: 444.59172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=C(C=C(S3)C(=O)N4CCN(CC4)CCC5=CC=CC=C5)C(=N2)C

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(C=C(S3)C(=O)N4CCN(CC4)CCC5=CC=CC=C5)C(=N2)C

InChI

InChI=1S/C26H28N4OS/c1-19-8-6-7-11-23(19)30-26-22(20(2)27-30)18-24(32-26)25(31)29-16-14-28(15-17-29)13-12-21-9-4-3-5-10-21/h3-11,18H,12-17H2,1-2H3