7-chloranyl-2-methylsulfanyl-3-(phenylsulfonyl)-5-propan-2-yl-pyrazolo[1,5-a]pyrimidine

Systemtic Name: 7-chloranyl-2-methylsulfanyl-3-(phenylsulfonyl)-5-propan-2-yl-pyrazolo[1,5-a]pyrimidine Openeye Name: 3-(benzenesulfonyl)-7-chloro-5-isopropyl-2-methylsulfanyl-pyrazolo[1,5-a]pyrimidine CAS Name: 3-(benzenesulfonyl)-7-chloro-2-(methylthio)-5-propan-2-ylpyrazolo[1,5-a]pyrimidine IUPAC Name: 3-(benzenesulfonyl)-7-chloro-2-methylsulfanyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidine Traditional Name: 3-besyl-7-chloro-5-isopropyl-2-(methylthio)pyrazolo[1,5-a]pyrimidine Formula: C16H16ClN3O2S2 MolecularWeight: 381.90014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClN3O2S2/c1-10(2)12-9-13(17)20-15(18-12)14(16(19-20)23-3)24(21,22)11-7-5-4-6-8-11/h4-10H,1-3H3