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

Systemtic Name: N-[4-[[3-bromanyl-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]butyl]-5-chloranyl-1,3-dimethyl-pyrazole-4-sulfonamide Openeye Name: N-[4-[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]butyl]-5-chloro-1,3-dimethyl-pyrazole-4-sulfonamide CAS Name: N-[4-[[3-bromo-5-(2-chlorophenyl)-7-pyrazolo[1,5-a]pyrimidinyl]amino]butyl]-5-chloro-1,3-dimethyl-4-pyrazolesulfonamide IUPAC Name: N-[4-[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]butyl]-5-chloro-1,3-dimethylpyrazole-4-sulfonamide Traditional Name: N-[4-[[3-bromo-5-(2-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]amino]butyl]-5-chloro-1,3-dimethyl-pyrazole-4-sulfonamide Formula: C21H22BrCl2N7O2S MolecularWeight: 587.32008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)NCCCCNC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4Cl)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)NCCCCNC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4Cl)Cl)C

InChI

InChI=1S/C21H22BrCl2N7O2S/c1-13-19(20(24)30(2)29-13)34(32,33)27-10-6-5-9-25-18-11-17(14-7-3-4-8-16(14)23)28-21-15(22)12-26-31(18)21/h3-4,7-8,11-12,25,27H,5-6,9-10H2,1-2H3