2-chloranyl-N-[4-[(6-methylpyrimidin-4-yl)amino]phenyl]-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-[(6-methylpyrimidin-4-yl)amino]phenyl]-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[4-[(6-methylpyrimidin-4-yl)amino]phenyl]-5-morpholinosulfonyl-benzamide CAS Name: 2-chloro-N-[4-[(6-methyl-4-pyrimidinyl)amino]phenyl]-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[4-[(6-methylpyrimidin-4-yl)amino]phenyl]-5-morpholin-4-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[4-[(6-methylpyrimidin-4-yl)amino]phenyl]-5-morpholinosulfonyl-benzamide Formula: C22H22ClN5O4S MolecularWeight: 487.95918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)NC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

Isomeric SMILES

CC1=CC(=NC=N1)NC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

InChI

InChI=1S/C22H22ClN5O4S/c1-15-12-21(25-14-24-15)26-16-2-4-17(5-3-16)27-22(29)19-13-18(6-7-20(19)23)33(30,31)28-8-10-32-11-9-28/h2-7,12-14H,8-11H2,1H3,(H,27,29)(H,24,25,26)