N-[4-[[3-bromanyl-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]butyl]-3-chloranyl-benzamide

Systemtic Name: N-[4-[[3-bromanyl-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]butyl]-3-chloranyl-benzamide Openeye Name: N-[4-[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]butyl]-3-chloro-benzamide CAS Name: N-[4-[[3-bromo-5-(2-chlorophenyl)-7-pyrazolo[1,5-a]pyrimidinyl]amino]butyl]-3-chlorobenzamide IUPAC Name: N-[4-[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]butyl]-3-chlorobenzamide Traditional Name: N-[4-[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]butyl]-3-chloro-benzamide Formula: C23H20BrCl2N5O MolecularWeight: 533.2478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(C=NN3C(=C2)NCCCCNC(=O)C4=CC(=CC=C4)Cl)Br)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(C=NN3C(=C2)NCCCCNC(=O)C4=CC(=CC=C4)Cl)Br)Cl

InChI

InChI=1S/C23H20BrCl2N5O/c24-18-14-29-31-21(13-20(30-22(18)31)17-8-1-2-9-19(17)26)27-10-3-4-11-28-23(32)15-6-5-7-16(25)12-15/h1-2,5-9,12-14,27H,3-4,10-11H2,(H,28,32)