(4-tert-butylphenyl)-(3,5-dimethyl-4-phenylsulfanyl-pyrazol-1-yl)methanone

Systemtic Name: (4-tert-butylphenyl)-(3,5-dimethyl-4-phenylsulfanyl-pyrazol-1-yl)methanone Openeye Name: (4-tert-butylphenyl)-(3,5-dimethyl-4-phenylsulfanyl-pyrazol-1-yl)methanone CAS Name: (4-tert-butylphenyl)-[3,5-dimethyl-4-(phenylthio)-1-pyrazolyl]methanone IUPAC Name: (4-tert-butylphenyl)-(3,5-dimethyl-4-phenylsulfanylpyrazol-1-yl)methanone Traditional Name: (4-tert-butylphenyl)-[3,5-dimethyl-4-(phenylthio)pyrazol-1-yl]methanone Formula: C22H24N2OS MolecularWeight: 364.50376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)C2=CC=C(C=C2)C(C)(C)C)C)SC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C(=O)C2=CC=C(C=C2)C(C)(C)C)C)SC3=CC=CC=C3

InChI

InChI=1S/C22H24N2OS/c1-15-20(26-19-9-7-6-8-10-19)16(2)24(23-15)21(25)17-11-13-18(14-12-17)22(3,4)5/h6-14H,1-5H3