[1-(4-bromophenyl)sulfonylpyrrolidin-2-yl]-[3,5-dimethyl-4-(4-methylphenyl)sulfanyl-pyrazol-1-yl]methanone

Systemtic Name: [1-(4-bromophenyl)sulfonylpyrrolidin-2-yl]-[3,5-dimethyl-4-(4-methylphenyl)sulfanyl-pyrazol-1-yl]methanone Openeye Name: [1-(4-bromophenyl)sulfonylpyrrolidin-2-yl]-[3,5-dimethyl-4-(p-tolylsulfanyl)pyrazol-1-yl]methanone CAS Name: [1-(4-bromophenyl)sulfonyl-2-pyrrolidinyl]-[3,5-dimethyl-4-[(4-methylphenyl)thio]-1-pyrazolyl]methanone IUPAC Name: [1-(4-bromophenyl)sulfonylpyrrolidin-2-yl]-[3,5-dimethyl-4-(4-methylphenyl)sulfanylpyrazol-1-yl]methanone Traditional Name: (1-brosylpyrrolidin-2-yl)-[3,5-dimethyl-4-(p-tolylthio)pyrazol-1-yl]methanone Formula: C23H24BrN3O3S2 MolecularWeight: 534.48896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(N(N=C2C)C(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(N(N=C2C)C(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C23H24BrN3O3S2/c1-15-6-10-19(11-7-15)31-22-16(2)25-27(17(22)3)23(28)21-5-4-14-26(21)32(29,30)20-12-8-18(24)9-13-20/h6-13,21H,4-5,14H2,1-3H3