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

Systemtic Name: N-[3-[[3-bromanyl-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl]-4-methylsulfanyl-benzamide Openeye Name: N-[3-[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl]-4-methylsulfanyl-benzamide CAS Name: N-[3-[[3-bromo-5-(2-chlorophenyl)-7-pyrazolo[1,5-a]pyrimidinyl]amino]propyl]-4-(methylthio)benzamide IUPAC Name: N-[3-[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl]-4-methylsulfanylbenzamide Traditional Name: N-[3-[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl]-4-(methylthio)benzamide Formula: C23H21BrClN5OS MolecularWeight: 530.86774

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)NCCCNC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4Cl

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)NCCCNC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4Cl

InChI

InChI=1S/C23H21BrClN5OS/c1-32-16-9-7-15(8-10-16)23(31)27-12-4-11-26-21-13-20(17-5-2-3-6-19(17)25)29-22-18(24)14-28-30(21)22/h2-3,5-10,13-14,26H,4,11-12H2,1H3,(H,27,31)