N-[4-[(5R)-3-(6-bromanyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-phenyl-pyrazolidin-1-yl]carbonylphenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-[(5R)-3-(6-bromanyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-phenyl-pyrazolidin-1-yl]carbonylphenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-[(5R)-3-(6-bromo-2-oxo-4-phenyl-3-quinolylidene)-5-phenyl-pyrazolidine-1-carbonyl]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-[[(5R)-3-(6-bromo-2-oxo-4-phenyl-3-quinolinylidene)-5-phenyl-1-pyrazolidinyl]-oxomethyl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-[(5R)-3-(6-bromo-2-oxo-4-phenylquinolin-3-ylidene)-5-phenylpyrazolidine-1-carbonyl]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-[(5R)-3-(6-bromo-2-keto-4-phenyl-3-quinolylidene)-5-phenyl-pyrazolidine-1-carbonyl]phenyl]-4-methyl-benzenesulfonamide Formula: C38H29BrN4O4S MolecularWeight: 717.63026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3C(CC(=C4C(=C5C=C(C=CC5=NC4=O)Br)C6=CC=CC=C6)N3)C7=CC=CC=C7

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3[C@H](CC(=C4C(=C5C=C(C=CC5=NC4=O)Br)C6=CC=CC=C6)N3)C7=CC=CC=C7

InChI

InChI=1S/C38H29BrN4O4S/c1-24-12-19-30(20-13-24)48(46,47)42-29-17-14-27(15-18-29)38(45)43-34(25-8-4-2-5-9-25)23-33(41-43)36-35(26-10-6-3-7-11-26)31-22-28(39)16-21-32(31)40-37(36)44/h2-22,34,41-42H,23H2,1H3/t34-/m1/s1