4-[4-[(2R)-2-(6-chloranyl-3,4-dihydro-2H-quinolin-1-yl)propanoyl]-2-oxidanylidene-piperazin-1-yl]-N-pyrimidin-4-yl-benzenesulfonamide

Systemtic Name: 4-[4-[(2R)-2-(6-chloranyl-3,4-dihydro-2H-quinolin-1-yl)propanoyl]-2-oxidanylidene-piperazin-1-yl]-N-pyrimidin-4-yl-benzenesulfonamide Openeye Name: 4-[4-[(2R)-2-(6-chloro-3,4-dihydro-2H-quinolin-1-yl)propanoyl]-2-oxo-piperazin-1-yl]-N-pyrimidin-4-yl-benzenesulfonamide CAS Name: 4-[4-[(2R)-2-(6-chloro-3,4-dihydro-2H-quinolin-1-yl)-1-oxopropyl]-2-oxo-1-piperazinyl]-N-(4-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[4-[(2R)-2-(6-chloro-3,4-dihydro-2H-quinolin-1-yl)propanoyl]-2-oxopiperazin-1-yl]-N-pyrimidin-4-ylbenzenesulfonamide Traditional Name: 4-[4-[(2R)-2-(6-chloro-3,4-dihydro-2H-quinolin-1-yl)propanoyl]-2-keto-piperazino]-N-(4-pyrimidyl)benzenesulfonamide Formula: C26H27ClN6O4S MolecularWeight: 555.04838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(C(=O)C1)C2=CC=C(C=C2)S(=O)(=O)NC3=NC=NC=C3)N4CCCC5=C4C=CC(=C5)Cl

Isomeric SMILES

C[C@H](C(=O)N1CCN(C(=O)C1)C2=CC=C(C=C2)S(=O)(=O)NC3=NC=NC=C3)N4CCCC5=C4C=CC(=C5)Cl

InChI

InChI=1S/C26H27ClN6O4S/c1-18(32-12-2-3-19-15-20(27)4-9-23(19)32)26(35)31-13-14-33(25(34)16-31)21-5-7-22(8-6-21)38(36,37)30-24-10-11-28-17-29-24/h4-11,15,17-18H,2-3,12-14,16H2,1H3,(H,28,29,30)/t18-/m1/s1