3-[5-(4-bromophenyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]-2-chloranyl-6-methyl-quinoline

Systemtic Name: 3-[5-(4-bromophenyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]-2-chloranyl-6-methyl-quinoline Openeye Name: 3-[5-(4-bromophenyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]-2-chloro-6-methyl-quinoline CAS Name: 3-[5-(4-bromophenyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]-2-chloro-6-methylquinoline IUPAC Name: 3-[5-(4-bromophenyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]-2-chloro-6-methylquinoline Traditional Name: 3-[5-(4-bromophenyl)-2-mesyl-2-pyrazolin-3-yl]-2-chloro-6-methyl-quinoline Formula: C20H17BrClN3O2S MolecularWeight: 478.78988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)Cl)C3CC(=NN3S(=O)(=O)C)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)Cl)C3CC(=NN3S(=O)(=O)C)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H17BrClN3O2S/c1-12-3-8-17-14(9-12)10-16(20(22)23-17)19-11-18(24-25(19)28(2,26)27)13-4-6-15(21)7-5-13/h3-10,19H,11H2,1-2H3