(3S)-5-(4-bromophenyl)-3-(furan-2-yl)-2-methylsulfonyl-1,3-dihydropyrazole

Systemtic Name: (3S)-5-(4-bromophenyl)-3-(furan-2-yl)-2-methylsulfonyl-1,3-dihydropyrazole Openeye Name: (3S)-5-(4-bromophenyl)-3-(2-furyl)-2-methylsulfonyl-1,3-dihydropyrazole CAS Name: (3S)-5-(4-bromophenyl)-3-(2-furanyl)-2-methylsulfonyl-1,3-dihydropyrazole IUPAC Name: (3S)-5-(4-bromophenyl)-3-(furan-2-yl)-2-methylsulfonyl-1,3-dihydropyrazole Traditional Name: (5S)-3-(4-bromophenyl)-5-(2-furyl)-1-mesyl-3-pyrazoline Formula: C14H13BrN2O3S MolecularWeight: 369.23362

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(C=C(N1)C2=CC=C(C=C2)Br)C3=CC=CO3

Isomeric SMILES

CS(=O)(=O)N1[C@@H](C=C(N1)C2=CC=C(C=C2)Br)C3=CC=CO3

InChI

InChI=1S/C14H13BrN2O3S/c1-21(18,19)17-13(14-3-2-8-20-14)9-12(16-17)10-4-6-11(15)7-5-10/h2-9,13,16H,1H3/t13-/m0/s1