1-[7-chloranyl-2-methylsulfanyl-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N,N-dimethyl-methanamine

Systemtic Name: 1-[7-chloranyl-2-methylsulfanyl-3-(phenylsulfonyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N,N-dimethyl-methanamine Openeye Name: 1-[3-(benzenesulfonyl)-7-chloro-2-methylsulfanyl-pyrazolo[1,5-a]pyrimidin-5-yl]-N,N-dimethyl-methanamine CAS Name: 1-[3-(benzenesulfonyl)-7-chloro-2-(methylthio)-5-pyrazolo[1,5-a]pyrimidinyl]-N,N-dimethylmethanamine IUPAC Name: 1-[3-(benzenesulfonyl)-7-chloro-2-methylsulfanylpyrazolo[1,5-a]pyrimidin-5-yl]-N,N-dimethylmethanamine Traditional Name: [3-besyl-7-chloro-2-(methylthio)pyrazolo[1,5-a]pyrimidin-5-yl]methyl-dimethyl-amine Formula: C16H17ClN4O2S2 MolecularWeight: 396.91478

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC2=C(C(=NN2C(=C1)Cl)SC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C)CC1=NC2=C(C(=NN2C(=C1)Cl)SC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H17ClN4O2S2/c1-20(2)10-11-9-13(17)21-15(18-11)14(16(19-21)24-3)25(22,23)12-7-5-4-6-8-12/h4-9H,10H2,1-3H3