2-cyclohexylsulfanyl-1-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-cyclohexylsulfanyl-1-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-cyclohexylsulfanyl-1-[3-(p-tolyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-(cyclohexylthio)-1-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-cyclohexylsulfanyl-1-[3-(4-methylphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-(cyclohexylthio)-1-[5-(p-tolyl)-3-(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C22H26N2OS2 MolecularWeight: 398.58464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3CCCCC3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=NN2C(=O)CSC3CCCCC3)C4=CC=CS4

InChI

InChI=1S/C22H26N2OS2/c1-16-9-11-17(12-10-16)20-14-19(21-8-5-13-26-21)23-24(20)22(25)15-27-18-6-3-2-4-7-18/h5,8-13,18,20H,2-4,6-7,14-15H2,1H3