2-chloranyl-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[4-[(6-phenyl-4-pyrimidinyl)amino]phenyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[4-[(6-phenylpyrimidin-4-yl)amino]phenyl]-5-piperidinosulfonyl-benzamide Formula: C28H26ClN5O3S MolecularWeight: 548.05574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)NC4=NC=NC(=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)NC4=NC=NC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H26ClN5O3S/c29-25-14-13-23(38(36,37)34-15-5-2-6-16-34)17-24(25)28(35)33-22-11-9-21(10-12-22)32-27-18-26(30-19-31-27)20-7-3-1-4-8-20/h1,3-4,7-14,17-19H,2,5-6,15-16H2,(H,33,35)(H,30,31,32)